Motif_1: [mass:157.1012]->C1=CC(=O)CCC1C [mass:145.1012]->C1=CC(=O)CCC1C [mass:119.0855]->C1=CC(=O)CCC1C [mass:147.0804]->CC1=CC(=O)C=CC1C [mass:135.0804]->CC1=CC(=O)C=CC1C [mass:161.0961]->CC1=CC(=O)C=CC1C [mass:121.0648]->CC12C=CC(=O)C=C1CCC1C2C(O)CC2(C)C(CCC12)C(=O)CO [mass, mass:147.0804, 121.0648]->CC12C=CC(=O)C=C1CCC1C2C(O)CC2(C)C(CCC12)C(=O)CO [mass:173.0961]->CCC1=CC(=O)C=CC1C [mass, mass:147.0804, 119.0855]->CCC1=CC(=O)C=CC1C [mass, mass:135.0804, 121.0648]->CC(=O)C1C(C)CC2C3CCC4=CC(=O)C=CC4(C)C3C(O)CC21C [mass, mass:145.1012, 119.0855]->C#CC1(O)CCC2C3CCC4=CC(=O)CCC4C3CCC21C [mass:133.1012]->C1(=CC(=O)CCC1C)CC [mass, mass:133.1012, 119.0855]->C1(=CC(=O)CCC1C)CC [mass, mass:107.0855, 119.0855]->C1(=CC(=O)CCC1C)CC [mass:107.0855]->CC1=CC(=O)CCC1C Motif_6: [mass:148.0757]->N(CC(Cn1c(=O)cccc1)C)(C)C [mass:157.1012]->C1=CC(=O)CCC1C [mass:152.062]->C(c1ccccc1)c1ccccc1 [mass:167.0855]->C(c1ccccc1)c1ccccc1 [mass:165.0699]->cc-c1ccccc1 [mass:153.0699]->CCN=C(O)COC1:C:C:C2:C:C:C(=O):O:C:2:C:1 Motif_21: [mass:121.0648]->CC12C=CC(=O)C=C1CCC1C2C(O)CC2(C)C(CCC12)C(=O)CO [mass:103.0542]->CCc1ccccc1 [mass:91.0542]->CCc1ccccc1 [mass, mass:91.0542, 103.0542]->CCOC(=O)C(C)C1:C:C:C:C:C:1 [mass, mass:121.0648, 103.0542]->COc1ccccc1 Motif_25: [mass:158.06]->CC1=C[N]([H])C2=C1C=CC=C2 [mass:160.0757]->N(CC(Cn1c(=O)cccc1)C)(C)C [mass:117.0573]->c1(=O)cccc[nH]1 [mass:146.06]->C(C(=O)O)(N=CO)Cc1c2c(cccc2)[nH]c1 [mass, mass:132.0808, 130.0651]->C(Cc1c2c(cccc2)[nH]c1)(C=O)N [mass:142.0651]->C(Cc1c2c(cccc2)[nH]c1)(C=O)N [mass, mass:144.0808, 130.0651]->C(Cc1c2c(cccc2)[nH]c1)(C=O)N [mass, mass:130.0651, 115.0542]->C(Cc1c2c(cccc2)[nH]c1)(C=O)N [mass:132.0808]->C(Cc1c[nH]c2ccccc12)N= [mass:130.0651]->C(O)=NCCc1c[nH]c2ccccc12 [mass:144.0808]->C(O)=NCCc1c[nH]c2ccccc12 [mass, mass:130.0651, 103.0542]->OCC(O)=NC(Cc1ccccc1)C(=O)O [mass, mass:103.0542, 115.0542]->CC(N=C(O)CO)C(=O)O [mass, mass, mass:129.0699, 103.0542, 115.0542]->CC(N=C(O)CO)C(=O)O [mass:103.0542]->CCc1ccccc1 [mass:129.0699]->CC1=CC(=CCC2CCCCC2C)CCC1 [mass:115.0542]->C:C:C(=O):O:C1:C:C:C:C(:C:1)OCC(O)=NCC [mass, mass:129.0699, 103.0542]->OCC(O)=NCC(=O)O [mass, mass:129.0699, 115.0542]->CCC1:C(C):C2:C:C:C:C:C:2:O:C:1=O [mass:154.0651]->C1:C:C:C2:N:C:C:C:C:2:C:1 Motif_26: [mass:158.06]->CC1=C[N]([H])C2=C1C=CC=C2 [mass:160.0757]->N(CC(Cn1c(=O)cccc1)C)(C)C [mass:148.0757]->N(CC(Cn1c(=O)cccc1)C)(C)C [mass:132.0444]->N(CC(Cn1c(=O)cccc1)C)(C)C [mass:134.06]->N(CC(Cn1c(=O)cccc1)C)(C)C [mass:117.0573]->c1(=O)cccc[nH]1 [mass:146.06]->C(C(=O)O)(N=CO)Cc1c2c(cccc2)[nH]c1 [mass:172.0757]->O=C1:C:C:C:C2C3CC(CN(C3)C(O)=NC3:C:C:C:C:C:3)CN:2:1 [mass:132.0808]->C(Cc1c[nH]c2ccccc12)N= Motif_28: [mass:161.0597]->C1(Oc2c(c3c(cc2)ccc(=O)o3)CC1)(C)C [mass:157.1012]->C1=CC(=O)CCC1C [mass:119.0855]->C1=CC(=O)CCC1C [mass:147.0804]->CC1=CC(=O)C=CC1C [mass:135.0804]->CC1=CC(=O)C=CC1C [mass, mass:159.0804, 147.0804]->C1CCC2=CC(=O)C=CC2(C)C1 [mass:173.0961]->CCC1=CC(=O)C=CC1C [mass, mass:147.0804, 119.0855]->CCC1=CC(=O)C=CC1C [mass:159.0804]->C1=CC(=O)C=CC1C [mass:145.0648]->C1=CC(=O)C=CC1C [mass, mass:147.0804, 145.0648]->C1=CC(=O)C=CC1C [mass, mass:159.0804, 145.0648]->C1=CC(=O)C=CC1C [mass:175.0754]->COc1cc(C)cc2oc(=O)ccc12 [mass, mass:119.0855, 129.0699]->C#CC1(O)CCC2C3CCC4=CC(=O)CCC4C3CCC21C [mass:149.0597]->C(OC(=C)C)(C)(C)C [mass:129.0699]->CC1=CC(=CCC2CCCCC2C)CCC1 [mass:133.0648]->COC1:C:C:C:C(:C:1)CCN [mass, mass:145.0648, 129.0699]->OCC(O)=NCC(=O)O Motif_29: [mass:142.0651]->C(Cc1c2c(cccc2)[nH]c1)(C=O)N [mass:144.0808]->C(O)=NCCc1c[nH]c2ccccc12 [mdiff:78.047]->CC12CCCC1C1CCC3=CC(=O)CCC3(C)C1CC2 [mass:115.0542]->C:C:C(=O):O:C1:C:C:C:C(:C:1)OCC(O)=NCC [mass:128.062]->CCC1:C(C):C2:C:C:C:C:C:2:O:C:1=O [mass, mass:128.062, 115.0542]->CCC1:C(C):C2:C:C:C:C:C:2:O:C:1=O Motif_30: [mass:157.1012]->C1=CC(=O)CCC1C [mass:145.1012]->C1=CC(=O)CCC1C [mass, mass:145.1012, 131.0855]->C1=CC(=O)CCC1C [mass:143.0855]->C#CC1(O)CCC2C3CCC4=CC(=O)CCC4C3CCC21C [mass, mass:143.0855, 131.0855]->C#CC1(O)CCC2C3CCC4=CC(=O)CCC4C3CCC21C [mass:155.0855]->C#CC1(O)CCC2C3CCC4=CC(=O)CCC4C3CCC21C [mass:131.0855]->CC12CC=C3C(CCC4CCCCC34C)C1CCC2 [mass, mass:145.1012, 143.0855]->C1(=CC(=O)CCC1C)CC Motif_32: [mass:157.1012]->C1=CC(=O)CCC1C [mass:145.1012]->C1=CC(=O)CCC1C [mass:119.0855]->C1=CC(=O)CCC1C [mass, mass:145.1012, 131.0855]->C1=CC(=O)CCC1C [mass:143.0855]->C#CC1(O)CCC2C3CCC4=CC(=O)CCC4C3CCC21C [mass, mass:143.0855, 131.0855]->C#CC1(O)CCC2C3CCC4=CC(=O)CCC4C3CCC21C [mass, mass:145.1012, 119.0855]->C#CC1(O)CCC2C3CCC4=CC(=O)CCC4C3CCC21C [mass:155.0855]->C#CC1(O)CCC2C3CCC4=CC(=O)CCC4C3CCC21C [mass:131.0855]->CC12CC=C3C(CCC4CCCCC34C)C1CCC2 [mass, mass:131.0855, 119.0855]->CC12CC=C3C(CCC4CCCCC34C)C1CCC2 [mass, mass:143.0855, 119.0855]->C1(=CC(=O)CCC1C)CC [mass, mass:145.1012, 143.0855]->C1(=CC(=O)CCC1C)CC [mass:133.1012]->C1(=CC(=O)CCC1C)CC [mass, mass:133.1012, 119.0855]->C1(=CC(=O)CCC1C)CC [mass, mass:107.0855, 119.0855]->C1(=CC(=O)CCC1C)CC [mass:107.0855]->CC1=CC(=O)CCC1C Motif_33: [mass:158.06]->CC1=C[N]([H])C2=C1C=CC=C2 [mass:160.0757]->N(CC(Cn1c(=O)cccc1)C)(C)C [mass:117.0573]->c1(=O)cccc[nH]1 [mass, mass:132.0808, 130.0651]->C(Cc1c2c(cccc2)[nH]c1)(C=O)N [mass:142.0651]->C(Cc1c2c(cccc2)[nH]c1)(C=O)N [mass, mass:144.0808, 130.0651]->C(Cc1c2c(cccc2)[nH]c1)(C=O)N [mass, mass:130.0651, 115.0542]->C(Cc1c2c(cccc2)[nH]c1)(C=O)N [mass:132.0808]->C(Cc1c[nH]c2ccccc12)N= [mass:130.0651]->C(O)=NCCc1c[nH]c2ccccc12 [mass:144.0808]->C(O)=NCCc1c[nH]c2ccccc12 [mass, mass:130.0651, 103.0542]->OCC(O)=NC(Cc1ccccc1)C(=O)O [mass, mass:103.0542, 115.0542]->CC(N=C(O)CO)C(=O)O [mass:103.0542]->CCc1ccccc1 [mass:115.0542]->C:C:C(=O):O:C1:C:C:C:C(:C:1)OCC(O)=NCC Motif_36: [mass:161.0597]->C1(Oc2c(c3c(cc2)ccc(=O)o3)CC1)(C)C [mass:131.0855]->CC12CC=C3C(CCC4CCCCC34C)C1CCC2 [mass:159.0804]->C1=CC(=O)C=CC1C [mass:161.0961]->CC1=CC(=O)C=CC1C [mass:133.1012]->C1(=CC(=O)CCC1C)CC [mass:175.0754]->COc1cc(C)cc2oc(=O)ccc12 [mass, mass:131.0855, 129.0699]->C#CC1(O)CCC2C3CCC4=CC(=O)CCC4C3CCC21C [mass:103.0542]->CCc1ccccc1 [mass:129.0699]->CC1=CC(=CCC2CCCCC2C)CCC1 [mass:141.0699]->CCC1:C(C):C2:C:C:C:C:C:2:O:C:1=O [mass, mass:129.0699, 103.0542]->OCC(O)=NCC(=O)O [mass, mass:141.0699, 129.0699]->O=C1C=CCCC1 Motif_37: [mass:147.0441]->c1ccc(=O)oc1 [mass:119.0491]->C(=C\C)(\C=C)/O [mass:91.0542]->CCc1ccccc1 Motif_39: [mass:157.1012]->C1=CC(=O)CCC1C [mass:145.1012]->C1=CC(=O)CCC1C [mass:119.0855]->C1=CC(=O)CCC1C [mass, mass:145.1012, 131.0855]->C1=CC(=O)CCC1C [mass:143.0855]->C#CC1(O)CCC2C3CCC4=CC(=O)CCC4C3CCC21C [mass, mass:143.0855, 131.0855]->C#CC1(O)CCC2C3CCC4=CC(=O)CCC4C3CCC21C [mass, mass:145.1012, 119.0855]->C#CC1(O)CCC2C3CCC4=CC(=O)CCC4C3CCC21C [mass, mass:143.0855, 129.0699]->C#CC1(O)CCC2C3CCC4=CC(=O)CCC4C3CCC21C [mass, mass:119.0855, 129.0699]->C#CC1(O)CCC2C3CCC4=CC(=O)CCC4C3CCC21C [mass, mass:131.0855, 129.0699]->C#CC1(O)CCC2C3CCC4=CC(=O)CCC4C3CCC21C [mass:131.0855]->CC12CC=C3C(CCC4CCCCC34C)C1CCC2 [mass, mass:131.0855, 119.0855]->CC12CC=C3C(CCC4CCCCC34C)C1CCC2 [mass, mass:143.0855, 119.0855]->C1(=CC(=O)CCC1C)CC [mass, mass:145.1012, 143.0855]->C1(=CC(=O)CCC1C)CC [mass:133.1012]->C1(=CC(=O)CCC1C)CC [mass, mass:133.1012, 119.0855]->C1(=CC(=O)CCC1C)CC [mass, mass:107.0855, 119.0855]->C1(=CC(=O)CCC1C)CC [mass:107.0855]->CC1=CC(=O)CCC1C [mass:129.0699]->CC1=CC(=CCC2CCCCC2C)CCC1 Motif_41: [mass:161.0597]->C1(Oc2c(c3c(cc2)ccc(=O)o3)CC1)(C)C [mass:143.0855]->C#CC1(O)CCC2C3CCC4=CC(=O)CCC4C3CCC21C [mass, mass:143.0855, 129.0699]->C#CC1(O)CCC2C3CCC4=CC(=O)CCC4C3CCC21C [mass:171.0804]->CC1=CC(=O)C=CC1C [mass:145.0648]->C1=CC(=O)C=CC1C [mass:129.0699]->CC1=CC(=CCC2CCCCC2C)CCC1 [mass, mass:145.0648, 129.0699]->OCC(O)=NCC(=O)O Motif_50: [mass:157.1012]->C1=CC(=O)CCC1C [mass:145.1012]->C1=CC(=O)CCC1C [mass:119.0855]->C1=CC(=O)CCC1C [mass, mass:145.1012, 131.0855]->C1=CC(=O)CCC1C [mass:143.0855]->C#CC1(O)CCC2C3CCC4=CC(=O)CCC4C3CCC21C [mass, mass:143.0855, 131.0855]->C#CC1(O)CCC2C3CCC4=CC(=O)CCC4C3CCC21C [mass, mass:145.1012, 119.0855]->C#CC1(O)CCC2C3CCC4=CC(=O)CCC4C3CCC21C [mass, mass:143.0855, 129.0699]->C#CC1(O)CCC2C3CCC4=CC(=O)CCC4C3CCC21C [mass:155.0855]->C#CC1(O)CCC2C3CCC4=CC(=O)CCC4C3CCC21C [mass, mass:119.0855, 129.0699]->C#CC1(O)CCC2C3CCC4=CC(=O)CCC4C3CCC21C [mass, mass:131.0855, 129.0699]->C#CC1(O)CCC2C3CCC4=CC(=O)CCC4C3CCC21C [mass, mass:155.0855, 129.0699]->C#CC1(O)CCC2C3CCC4=CC(=O)CCC4C3CCC21C [mass, mass:143.0855, 128.062]->C#CC1(O)CCC2C3CCC4=CC(=O)CCC4C3CCC21C [mass:131.0855]->CC12CC=C3C(CCC4CCCCC34C)C1CCC2 [mass, mass:131.0855, 119.0855]->CC12CC=C3C(CCC4CCCCC34C)C1CCC2 [mass, mass:143.0855, 119.0855]->C1(=CC(=O)CCC1C)CC [mass, mass:145.1012, 143.0855]->C1(=CC(=O)CCC1C)CC [mass:133.1012]->C1(=CC(=O)CCC1C)CC [mass, mass:133.1012, 119.0855]->C1(=CC(=O)CCC1C)CC [mass, mass:107.0855, 119.0855]->C1(=CC(=O)CCC1C)CC [mass:107.0855]->CC1=CC(=O)CCC1C [mass:167.0855]->C(c1ccccc1)c1ccccc1 [mass:129.0699]->CC1=CC(=CCC2CCCCC2C)CCC1 [mass:141.0699]->CCC1:C(C):C2:C:C:C:C:C:2:O:C:1=O [mass:128.062]->CCC1:C(C):C2:C:C:C:C:C:2:O:C:1=O [mass, mass:141.0699, 128.062]->CCC1:C(C):C2:C:C:C:C:C:2:O:C:1=O [mass, mass:141.0699, 129.0699]->O=C1C=CCCC1 [mass, mass:128.062, 129.0699]->C=C1CCC2CCCCC2C1CCC Motif_52: [mass:91.0542]->CCc1ccccc1 Motif_54: [mass:149.0597]->C(OC(=C)C)(C)(C)C [mass:115.0542]->C:C:C(=O):O:C1:C:C:C:C(:C:1)OCC(O)=NCC Motif_59: [mass:120.0808]->C(=O)(CC/C=C/C=C\C)O [mass:103.0542]->CCc1ccccc1 [mass:91.0542]->CCc1ccccc1 [mass, mass:91.0542, 103.0542]->CCOC(=O)C(C)C1:C:C:C:C:C:1 Motif_65: [mass:161.0597]->C1(Oc2c(c3c(cc2)ccc(=O)o3)CC1)(C)C [mass:185.0961]->N=C(O)CCc1c(C)c2cc3c(C)coc3cc2oc1=O [mass:173.0961]->CCC1=CC(=O)C=CC1C [mass:143.0855]->C#CC1(O)CCC2C3CCC4=CC(=O)CCC4C3CCC21C [mass, mass:143.0855, 129.0699]->C#CC1(O)CCC2C3CCC4=CC(=O)CCC4C3CCC21C [mass:155.0855]->C#CC1(O)CCC2C3CCC4=CC(=O)CCC4C3CCC21C [mass, mass:155.0855, 129.0699]->C#CC1(O)CCC2C3CCC4=CC(=O)CCC4C3CCC21C [mass, mass:143.0855, 128.062]->C#CC1(O)CCC2C3CCC4=CC(=O)CCC4C3CCC21C [mass:145.1012]->C1=CC(=O)CCC1C [mass, mass:145.1012, 143.0855]->C1(=CC(=O)CCC1C)CC [mass:171.0804]->CC1=CC(=O)C=CC1C [mass:145.0648]->C1=CC(=O)C=CC1C [mass:129.0699]->CC1=CC(=CCC2CCCCC2C)CCC1 [mass:115.0542]->C:C:C(=O):O:C1:C:C:C:C(:C:1)OCC(O)=NCC [mass, mass:145.0648, 115.0542]->CC(N=C(O)CO)C(=O)O [mass:128.062]->CCC1:C(C):C2:C:C:C:C:C:2:O:C:1=O [mass, mass:129.0699, 115.0542]->CCC1:C(C):C2:C:C:C:C:C:2:O:C:1=O [mass, mass:128.062, 115.0542]->CCC1:C(C):C2:C:C:C:C:C:2:O:C:1=O [mass, mass:143.0855, 115.0542]->CCC1:C(C):C2:C:C:C:C:C:2:O:C:1=O [mass, mass, mass:128.062, 129.0699, 115.0542]->CCC1:C(C):C2:C:C:C:C:C:2:O:C:1=O [mass, mass:145.0648, 129.0699]->OCC(O)=NCC(=O)O [mass, mass:128.062, 129.0699]->C=C1CCC2CCCCC2C1CCC Motif_68: [mass:129.0699]->CC1=CC(=CCC2CCCCC2C)CCC1 [mass:115.0542]->C:C:C(=O):O:C1:C:C:C:C(:C:1)OCC(O)=NCC [mass:141.0699]->CCC1:C(C):C2:C:C:C:C:C:2:O:C:1=O [mass:128.062]->CCC1:C(C):C2:C:C:C:C:C:2:O:C:1=O [mass, mass:129.0699, 115.0542]->CCC1:C(C):C2:C:C:C:C:C:2:O:C:1=O [mass, mass:128.062, 115.0542]->CCC1:C(C):C2:C:C:C:C:C:2:O:C:1=O [mass, mass:141.0699, 128.062]->CCC1:C(C):C2:C:C:C:C:C:2:O:C:1=O [mass, mass, mass:128.062, 129.0699, 115.0542]->CCC1:C(C):C2:C:C:C:C:C:2:O:C:1=O [mass, mass, mass:141.0699, 128.062, 115.0542]->CCC1:C(C):C2:C:C:C:C:C:2:O:C:1=O [mass, mass:141.0699, 129.0699]->O=C1C=CCCC1 [mdiff:42.047]->CNCC(C)O [mass, mass:128.062, 129.0699]->C=C1CCC2CCCCC2C1CCC [mass:157.0648]->C:C:C:C:C:C:C:CC1:C:C:C(O):C:C:1 [mass, mass:141.0699, 115.0542]->c1ccc(Cc2ccccc2)cc1 [mass:153.0699]->CCN=C(O)COC1:C:C:C2:C:C:C(=O):O:C:2:C:1 Motif_69: [mass:165.0699]->cc-c1ccccc1 [mass:129.0699]->CC1=CC(=CCC2CCCCC2C)CCC1 [mass:115.0542]->C:C:C(=O):O:C1:C:C:C:C(:C:1)OCC(O)=NCC [mass:141.0699]->CCC1:C(C):C2:C:C:C:C:C:2:O:C:1=O [mass:128.062]->CCC1:C(C):C2:C:C:C:C:C:2:O:C:1=O [mass, mass:129.0699, 115.0542]->CCC1:C(C):C2:C:C:C:C:C:2:O:C:1=O [mass, mass:128.062, 115.0542]->CCC1:C(C):C2:C:C:C:C:C:2:O:C:1=O [mass, mass:141.0699, 128.062]->CCC1:C(C):C2:C:C:C:C:C:2:O:C:1=O [mass, mass, mass:128.062, 129.0699, 115.0542]->CCC1:C(C):C2:C:C:C:C:C:2:O:C:1=O [mass, mass, mass:141.0699, 128.062, 115.0542]->CCC1:C(C):C2:C:C:C:C:C:2:O:C:1=O [mass, mass:141.0699, 129.0699]->O=C1C=CCCC1 [mass, mass:128.062, 129.0699]->C=C1CCC2CCCCC2C1CCC [mass, mass:141.0699, 115.0542]->c1ccc(Cc2ccccc2)cc1 Motif_70: [mdiff:43.0422]->CN1CCN(C)CC1 [mass:115.0542]->C:C:C(=O):O:C1:C:C:C:C(:C:1)OCC(O)=NCC [mdiff:71.0371]->CC(=O)N1CCC(CC1)C(=N)O [mdiff:31.0422]->CC1CCC(N)CC1 [mdiff:45.0578]->NC:CS Motif_71: [mass:155.0855]->C#CC1(O)CCC2C3CCC4=CC(=O)CCC4C3CCC21C [mass:152.062]->C(c1ccccc1)c1ccccc1 [mass:103.0542]->CCc1ccccc1 [mass:165.0699]->cc-c1ccccc1 [mass:141.0699]->CCC1:C(C):C2:C:C:C:C:C:2:O:C:1=O [mdiff:42.047]->CNCC(C)O [mass:153.0699]->CCN=C(O)COC1:C:C:C2:C:C:C(=O):O:C:2:C:1 Motif_78: [mass:171.0804]->CC1=CC(=O)C=CC1C [mass:107.0855]->CC1=CC(=O)CCC1C [mass:129.0699]->CC1=CC(=CCC2CCCCC2C)CCC1 [mdiff:43.0422]->CN1CCN(C)CC1 [mass:128.062]->CCC1:C(C):C2:C:C:C:C:C:2:O:C:1=O [mdiff:71.0371]->CC(=O)N1CCC(CC1)C(=N)O [mass, mass:128.062, 129.0699]->C=C1CCC2CCCCC2C1CCC Motif_85: [mass:131.0855]->CC12CC=C3C(CCC4CCCCC34C)C1CCC2 [mass:159.0804]->C1=CC(=O)C=CC1C [mass:161.0961]->CC1=CC(=O)C=CC1C [mass:103.0542]->CCc1ccccc1 [mass:133.0648]->COC1:C:C:C:C(:C:1)CCN [mass, mass:131.0491, 103.0542]->C(=O)CCc1ccccc1 [mass:131.0491]->c1ccc(O)cc1 Motif_105: [mass:147.0804]->CC1=CC(=O)C=CC1C [mass:161.0961]->CC1=CC(=O)C=CC1C [mass, mass:159.0804, 147.0804]->C1CCC2=CC(=O)C=CC2(C)C1 [mass:173.0961]->CCC1=CC(=O)C=CC1C [mass:159.0804]->C1=CC(=O)C=CC1C [mass:155.0855]->C#CC1(O)CCC2C3CCC4=CC(=O)CCC4C3CCC21C [mass, mass:155.0855, 129.0699]->C#CC1(O)CCC2C3CCC4=CC(=O)CCC4C3CCC21C [mass:129.0699]->CC1=CC(=CCC2CCCCC2C)CCC1 [mass:115.0542]->C:C:C(=O):O:C1:C:C:C:C(:C:1)OCC(O)=NCC [mass:141.0699]->CCC1:C(C):C2:C:C:C:C:C:2:O:C:1=O [mass:128.062]->CCC1:C(C):C2:C:C:C:C:C:2:O:C:1=O [mass, mass:129.0699, 115.0542]->CCC1:C(C):C2:C:C:C:C:C:2:O:C:1=O [mass, mass:128.062, 115.0542]->CCC1:C(C):C2:C:C:C:C:C:2:O:C:1=O [mass, mass:141.0699, 128.062]->CCC1:C(C):C2:C:C:C:C:C:2:O:C:1=O [mass, mass, mass:128.062, 129.0699, 115.0542]->CCC1:C(C):C2:C:C:C:C:C:2:O:C:1=O [mass, mass, mass:141.0699, 128.062, 115.0542]->CCC1:C(C):C2:C:C:C:C:C:2:O:C:1=O [mass, mass:141.0699, 129.0699]->O=C1C=CCCC1 [mass, mass:128.062, 129.0699]->C=C1CCC2CCCCC2C1CCC [mass, mass:141.0699, 115.0542]->c1ccc(Cc2ccccc2)cc1 Motif_106: [mass:105.0335]->C(C=O)(C)CCC [mass:143.0855]->C#CC1(O)CCC2C3CCC4=CC(=O)CCC4C3CCC21C [mass, mass:143.0855, 128.062]->C#CC1(O)CCC2C3CCC4=CC(=O)CCC4C3CCC21C [mass:135.0804]->CC1=CC(=O)C=CC1C [mass:107.0491]->c1cccc(c1)OC [mass:128.062]->CCC1:C(C):C2:C:C:C:C:C:2:O:C:1=O Motif_107: [mass:117.0573]->c1(=O)cccc[nH]1 [mass:146.06]->C(C(=O)O)(N=CO)Cc1c2c(cccc2)[nH]c1 [mass:115.0542]->C:C:C(=O):O:C1:C:C:C:C(:C:1)OCC(O)=NCC [mdiff:31.0422]->CC1CCC(N)CC1 [mdiff:45.0578]->NC:CS Motif_117: [mass:147.0804]->CC1=CC(=O)C=CC1C [mass:135.0804]->CC1=CC(=O)C=CC1C [mass:161.0961]->CC1=CC(=O)C=CC1C [mass, mass:159.0804, 147.0804]->C1CCC2=CC(=O)C=CC2(C)C1 [mass:185.0961]->N=C(O)CCc1c(C)c2cc3c(C)coc3cc2oc1=O [mass:173.0961]->CCC1=CC(=O)C=CC1C [mass, mass:147.0804, 119.0855]->CCC1=CC(=O)C=CC1C [mass:119.0855]->C1=CC(=O)CCC1C [mass:159.0804]->C1=CC(=O)C=CC1C Motif_122: [mass:161.0597]->C1(Oc2c(c3c(cc2)ccc(=O)o3)CC1)(C)C [mass:159.0804]->C1=CC(=O)C=CC1C [mass:129.0699]->CC1=CC(=CCC2CCCCC2C)CCC1 [mass:115.0542]->C:C:C(=O):O:C1:C:C:C:C(:C:1)OCC(O)=NCC [mass:141.0699]->CCC1:C(C):C2:C:C:C:C:C:2:O:C:1=O [mass:128.062]->CCC1:C(C):C2:C:C:C:C:C:2:O:C:1=O [mass, mass:129.0699, 115.0542]->CCC1:C(C):C2:C:C:C:C:C:2:O:C:1=O [mass, mass:128.062, 115.0542]->CCC1:C(C):C2:C:C:C:C:C:2:O:C:1=O [mass, mass:141.0699, 128.062]->CCC1:C(C):C2:C:C:C:C:C:2:O:C:1=O [mass, mass, mass:128.062, 129.0699, 115.0542]->CCC1:C(C):C2:C:C:C:C:C:2:O:C:1=O [mass, mass, mass:141.0699, 128.062, 115.0542]->CCC1:C(C):C2:C:C:C:C:C:2:O:C:1=O [mass, mass:141.0699, 129.0699]->O=C1C=CCCC1 [mass, mass:128.062, 129.0699]->C=C1CCC2CCCCC2C1CCC [mass:131.0491]->c1ccc(O)cc1 [mass, mass:141.0699, 115.0542]->c1ccc(Cc2ccccc2)cc1 [mass, mass:131.0491, 115.0542]->CC(N=)C(=O)O Motif_135: [mass:148.0757]->N(CC(Cn1c(=O)cccc1)C)(C)C [mass:135.0804]->CC1=CC(=O)C=CC1C [mass:155.0855]->C#CC1(O)CCC2C3CCC4=CC(=O)CCC4C3CCC21C [mass:152.062]->C(c1ccccc1)c1ccccc1 [mass:167.0855]->C(c1ccccc1)c1ccccc1 [mass:165.0699]->cc-c1ccccc1 [mass:133.0648]->COC1:C:C:C:C(:C:1)CCN [mass:153.0699]->CCN=C(O)COC1:C:C:C2:C:C:C(=O):O:C:2:C:1 Motif_140: [mass:159.0804]->C1=CC(=O)C=CC1C [mass:145.0648]->C1=CC(=O)C=CC1C [mass, mass:159.0804, 145.0648]->C1=CC(=O)C=CC1C [mdiff:57.0215]->CN=C(O)CO [mass:107.0491]->c1cccc(c1)OC [mass:133.0648]->COC1:C:C:C:C(:C:1)CCN Motif_156: [mass:148.0757]->N(CC(Cn1c(=O)cccc1)C)(C)C [mass:157.1012]->C1=CC(=O)CCC1C [mass:155.0855]->C#CC1(O)CCC2C3CCC4=CC(=O)CCC4C3CCC21C [mass, mass:155.0855, 129.0699]->C#CC1(O)CCC2C3CCC4=CC(=O)CCC4C3CCC21C [mass:129.0699]->CC1=CC(=CCC2CCCCC2C)CCC1 [mass:115.0542]->C:C:C(=O):O:C1:C:C:C:C(:C:1)OCC(O)=NCC [mass:141.0699]->CCC1:C(C):C2:C:C:C:C:C:2:O:C:1=O [mass:128.062]->CCC1:C(C):C2:C:C:C:C:C:2:O:C:1=O [mass, mass:129.0699, 115.0542]->CCC1:C(C):C2:C:C:C:C:C:2:O:C:1=O [mass, mass:128.062, 115.0542]->CCC1:C(C):C2:C:C:C:C:C:2:O:C:1=O [mass, mass:141.0699, 128.062]->CCC1:C(C):C2:C:C:C:C:C:2:O:C:1=O [mass, mass, mass:128.062, 129.0699, 115.0542]->CCC1:C(C):C2:C:C:C:C:C:2:O:C:1=O [mass, mass, mass:141.0699, 128.062, 115.0542]->CCC1:C(C):C2:C:C:C:C:C:2:O:C:1=O [mass, mass:141.0699, 129.0699]->O=C1C=CCCC1 [mass, mass:128.062, 129.0699]->C=C1CCC2CCCCC2C1CCC [mass, mass:141.0699, 115.0542]->c1ccc(Cc2ccccc2)cc1 Motif_157: [mass:147.0804]->CC1=CC(=O)C=CC1C [mass:173.0961]->CCC1=CC(=O)C=CC1C [mass, mass:147.0804, 119.0855]->CCC1=CC(=O)C=CC1C [mass:119.0855]->C1=CC(=O)CCC1C [mass:133.1012]->C1(=CC(=O)CCC1C)CC [mass, mass:133.1012, 119.0855]->C1(=CC(=O)CCC1C)CC [mass:155.0855]->C#CC1(O)CCC2C3CCC4=CC(=O)CCC4C3CCC21C [mass:167.0855]->C(c1ccccc1)c1ccccc1 [mass:141.0699]->CCC1:C(C):C2:C:C:C:C:C:2:O:C:1=O [mass:128.062]->CCC1:C(C):C2:C:C:C:C:C:2:O:C:1=O [mass, mass:141.0699, 128.062]->CCC1:C(C):C2:C:C:C:C:C:2:O:C:1=O Motif_160: [mass:105.0335]->C(C=O)(C)CCC [mass:165.0699]->cc-c1ccccc1 [mdiff:57.0215]->CN=C(O)CO [mdiff:56.9977]->C:C:C:C:C:C:C:CC1:C:C:C(O):C:C:1 [mass:154.0651]->C1:C:C:C2:N:C:C:C:C:2:C:1 [mass:127.0542]->CCc1c[nH]c2ccccc12 Motif_167: [mass:147.0804]->CC1=CC(=O)C=CC1C [mass:135.0804]->CC1=CC(=O)C=CC1C [mass:171.0804]->CC1=CC(=O)C=CC1C [mass:161.0961]->CC1=CC(=O)C=CC1C [mass:185.0961]->N=C(O)CCc1c(C)c2cc3c(C)coc3cc2oc1=O [mass:173.0961]->CCC1=CC(=O)C=CC1C Motif_175: [mass:146.06]->C(C(=O)O)(N=CO)Cc1c2c(cccc2)[nH]c1 [mass:172.0757]->O=C1:C:C:C:C2C3CC(CN(C3)C(O)=NC3:C:C:C:C:C:3)CN:2:1 [mass:147.0804]->CC1=CC(=O)C=CC1C [mass:161.0961]->CC1=CC(=O)C=CC1C [mass:145.0648]->C1=CC(=O)C=CC1C [mass, mass:147.0804, 145.0648]->C1=CC(=O)C=CC1C Motif_181: [mass:175.0754]->COc1cc(C)cc2oc(=O)ccc12 [mass:145.0648]->C1=CC(=O)C=CC1C [mass:165.0699]->cc-c1ccccc1 [mass:115.0542]->C:C:C(=O):O:C1:C:C:C:C(:C:1)OCC(O)=NCC [mass, mass:145.0648, 115.0542]->CC(N=C(O)CO)C(=O)O [mass:141.0699]->CCC1:C(C):C2:C:C:C:C:C:2:O:C:1=O [mass, mass:141.0699, 115.0542]->c1ccc(Cc2ccccc2)cc1 [mass:153.0699]->CCN=C(O)COC1:C:C:C2:C:C:C(=O):O:C:2:C:1 Motif_188: [mass:152.062]->C(c1ccccc1)c1ccccc1 [mass:167.0855]->C(c1ccccc1)c1ccccc1 [mass:165.0699]->cc-c1ccccc1 [mass:141.0699]->CCC1:C(C):C2:C:C:C:C:C:2:O:C:1=O [mass:153.0699]->CCN=C(O)COC1:C:C:C2:C:C:C(=O):O:C:2:C:1 Motif_191: [mass:147.0804]->CC1=CC(=O)C=CC1C [mass:171.0804]->CC1=CC(=O)C=CC1C [mass, mass:159.0804, 147.0804]->C1CCC2=CC(=O)C=CC2(C)C1 [mass:173.0961]->CCC1=CC(=O)C=CC1C [mass:159.0804]->C1=CC(=O)C=CC1C [mass:145.0648]->C1=CC(=O)C=CC1C [mass, mass:147.0804, 145.0648]->C1=CC(=O)C=CC1C [mass, mass:159.0804, 145.0648]->C1=CC(=O)C=CC1C [mass:141.0699]->CCC1:C(C):C2:C:C:C:C:C:2:O:C:1=O [mass:128.062]->CCC1:C(C):C2:C:C:C:C:C:2:O:C:1=O [mass, mass:141.0699, 128.062]->CCC1:C(C):C2:C:C:C:C:C:2:O:C:1=O [mass:154.0651]->C1:C:C:C2:N:C:C:C:C:2:C:1 [mass:157.0648]->C:C:C:C:C:C:C:CC1:C:C:C(O):C:C:1 Motif_194: [mass:146.06]->C(C(=O)O)(N=CO)Cc1c2c(cccc2)[nH]c1 [mass:142.0651]->C(Cc1c2c(cccc2)[nH]c1)(C=O)N [mass, mass:144.0808, 130.0651]->C(Cc1c2c(cccc2)[nH]c1)(C=O)N [mass:130.0651]->C(O)=NCCc1c[nH]c2ccccc12 [mass:144.0808]->C(O)=NCCc1c[nH]c2ccccc12 [mass:129.0699]->CC1=CC(=CCC2CCCCC2C)CCC1 [mass:141.0699]->CCC1:C(C):C2:C:C:C:C:C:2:O:C:1=O [mass:128.062]->CCC1:C(C):C2:C:C:C:C:C:2:O:C:1=O [mass, mass:141.0699, 128.062]->CCC1:C(C):C2:C:C:C:C:C:2:O:C:1=O [mass, mass:141.0699, 129.0699]->O=C1C=CCCC1 [mass, mass:128.062, 129.0699]->C=C1CCC2CCCCC2C1CCC [mass:154.0651]->C1:C:C:C2:N:C:C:C:C:2:C:1 [mass:153.0699]->CCN=C(O)COC1:C:C:C2:C:C:C(=O):O:C:2:C:1 [mdiff:45.0578]->NC:CS Motif_195: [mass:185.0961]->N=C(O)CCc1c(C)c2cc3c(C)coc3cc2oc1=O [mass:155.0855]->C#CC1(O)CCC2C3CCC4=CC(=O)CCC4C3CCC21C [mass, mass:155.0855, 129.0699]->C#CC1(O)CCC2C3CCC4=CC(=O)CCC4C3CCC21C [mass:152.062]->C(c1ccccc1)c1ccccc1 [mass:129.0699]->CC1=CC(=CCC2CCCCC2C)CCC1 [mass:115.0542]->C:C:C(=O):O:C1:C:C:C:C(:C:1)OCC(O)=NCC [mass:141.0699]->CCC1:C(C):C2:C:C:C:C:C:2:O:C:1=O [mass:128.062]->CCC1:C(C):C2:C:C:C:C:C:2:O:C:1=O [mass, mass:129.0699, 115.0542]->CCC1:C(C):C2:C:C:C:C:C:2:O:C:1=O [mass, mass:128.062, 115.0542]->CCC1:C(C):C2:C:C:C:C:C:2:O:C:1=O [mass, mass:141.0699, 128.062]->CCC1:C(C):C2:C:C:C:C:C:2:O:C:1=O [mass, mass, mass:128.062, 129.0699, 115.0542]->CCC1:C(C):C2:C:C:C:C:C:2:O:C:1=O [mass, mass, mass:141.0699, 128.062, 115.0542]->CCC1:C(C):C2:C:C:C:C:C:2:O:C:1=O [mass, mass:141.0699, 129.0699]->O=C1C=CCCC1 [mass, mass:128.062, 129.0699]->C=C1CCC2CCCCC2C1CCC [mass, mass:141.0699, 115.0542]->c1ccc(Cc2ccccc2)cc1 [mass:153.0699]->CCN=C(O)COC1:C:C:C2:C:C:C(=O):O:C:2:C:1 Motif_198: [mass:134.06]->N(CC(Cn1c(=O)cccc1)C)(C)C [mass:146.06]->C(C(=O)O)(N=CO)Cc1c2c(cccc2)[nH]c1 [mdiff:78.047]->CC12CCCC1C1CCC3=CC(=O)CCC3(C)C1CC2 [mass:165.0699]->cc-c1ccccc1 [mass:131.0491]->c1ccc(O)cc1 Motif_199: [mass:161.0597]->C1(Oc2c(c3c(cc2)ccc(=O)o3)CC1)(C)C [mass:175.0754]->COc1cc(C)cc2oc(=O)ccc12 [mass:145.0648]->C1=CC(=O)C=CC1C [mass:115.0542]->C:C:C(=O):O:C1:C:C:C:C(:C:1)OCC(O)=NCC [mass, mass:145.0648, 115.0542]->CC(N=C(O)CO)C(=O)O [mass:128.062]->CCC1:C(C):C2:C:C:C:C:C:2:O:C:1=O [mass, mass:128.062, 115.0542]->CCC1:C(C):C2:C:C:C:C:C:2:O:C:1=O [mass:133.0648]->COC1:C:C:C:C(:C:1)CCN [mass:157.0648]->C:C:C:C:C:C:C:CC1:C:C:C(O):C:C:1 Motif_214: [mass:143.0855]->C#CC1(O)CCC2C3CCC4=CC(=O)CCC4C3CCC21C [mass, mass:143.0855, 131.0855]->C#CC1(O)CCC2C3CCC4=CC(=O)CCC4C3CCC21C [mass:155.0855]->C#CC1(O)CCC2C3CCC4=CC(=O)CCC4C3CCC21C [mass:131.0855]->CC12CC=C3C(CCC4CCCCC34C)C1CCC2 [mass:133.1012]->C1(=CC(=O)CCC1C)CC [mass:107.0855]->CC1=CC(=O)CCC1C Motif_218: [mass:147.0804]->CC1=CC(=O)C=CC1C [mass:135.0804]->CC1=CC(=O)C=CC1C [mass:171.0804]->CC1=CC(=O)C=CC1C [mass:161.0961]->CC1=CC(=O)C=CC1C [mass:185.0961]->N=C(O)CCc1c(C)c2cc3c(C)coc3cc2oc1=O [mass:173.0961]->CCC1=CC(=O)C=CC1C [mass:105.0335]->C(C=O)(C)CCC [mass:165.0699]->cc-c1ccccc1 Motif_240: [mass:147.0804]->CC1=CC(=O)C=CC1C [mass:171.0804]->CC1=CC(=O)C=CC1C [mass, mass:159.0804, 147.0804]->C1CCC2=CC(=O)C=CC2(C)C1 [mass:173.0961]->CCC1=CC(=O)C=CC1C [mass:145.1012]->C1=CC(=O)CCC1C [mass, mass:145.1012, 131.0855]->C1=CC(=O)CCC1C [mass:131.0855]->CC12CC=C3C(CCC4CCCCC34C)C1CCC2 [mass:159.0804]->C1=CC(=O)C=CC1C [mass:145.0648]->C1=CC(=O)C=CC1C [mass, mass:147.0804, 145.0648]->C1=CC(=O)C=CC1C [mass, mass:159.0804, 145.0648]->C1=CC(=O)C=CC1C [mass:155.0855]->C#CC1(O)CCC2C3CCC4=CC(=O)CCC4C3CCC21C [mdiff:57.0215]->CN=C(O)CO [mass:157.0648]->C:C:C:C:C:C:C:CC1:C:C:C(O):C:C:1 Motif_252: [mass:130.0651]->C(O)=NCCc1c[nH]c2ccccc12 [mass:152.062]->C(c1ccccc1)c1ccccc1 [mass:165.0699]->cc-c1ccccc1 [mdiff:30.047]->CC1=CC(=CCC2CCCCC2C)CCC1 [mass:154.0651]->C1:C:C:C2:N:C:C:C:C:2:C:1 Motif_262: [mass:147.0804]->CC1=CC(=O)C=CC1C [mass:171.0804]->CC1=CC(=O)C=CC1C [mass:143.0855]->C#CC1(O)CCC2C3CCC4=CC(=O)CCC4C3CCC21C [mass, mass:143.0855, 131.0855]->C#CC1(O)CCC2C3CCC4=CC(=O)CCC4C3CCC21C [mass, mass:143.0855, 129.0699]->C#CC1(O)CCC2C3CCC4=CC(=O)CCC4C3CCC21C [mass, mass:119.0855, 129.0699]->C#CC1(O)CCC2C3CCC4=CC(=O)CCC4C3CCC21C [mass, mass:131.0855, 129.0699]->C#CC1(O)CCC2C3CCC4=CC(=O)CCC4C3CCC21C [mass, mass:143.0855, 128.062]->C#CC1(O)CCC2C3CCC4=CC(=O)CCC4C3CCC21C [mass:131.0855]->CC12CC=C3C(CCC4CCCCC34C)C1CCC2 [mass, mass:131.0855, 119.0855]->CC12CC=C3C(CCC4CCCCC34C)C1CCC2 [mass:119.0855]->C1=CC(=O)CCC1C [mass, mass:143.0855, 119.0855]->C1(=CC(=O)CCC1C)CC [mass, mass:147.0804, 119.0855]->CCC1=CC(=O)C=CC1C [mass:145.0648]->C1=CC(=O)C=CC1C [mass, mass:147.0804, 145.0648]->C1=CC(=O)C=CC1C [mass:129.0699]->CC1=CC(=CCC2CCCCC2C)CCC1 [mass:115.0542]->C:C:C(=O):O:C1:C:C:C:C(:C:1)OCC(O)=NCC [mass, mass:145.0648, 115.0542]->CC(N=C(O)CO)C(=O)O [mass:141.0699]->CCC1:C(C):C2:C:C:C:C:C:2:O:C:1=O [mass:128.062]->CCC1:C(C):C2:C:C:C:C:C:2:O:C:1=O [mass, mass:129.0699, 115.0542]->CCC1:C(C):C2:C:C:C:C:C:2:O:C:1=O [mass, mass:128.062, 115.0542]->CCC1:C(C):C2:C:C:C:C:C:2:O:C:1=O [mass, mass:141.0699, 128.062]->CCC1:C(C):C2:C:C:C:C:C:2:O:C:1=O [mass, mass:143.0855, 115.0542]->CCC1:C(C):C2:C:C:C:C:C:2:O:C:1=O [mass, mass, mass:128.062, 129.0699, 115.0542]->CCC1:C(C):C2:C:C:C:C:C:2:O:C:1=O [mass, mass, mass:141.0699, 128.062, 115.0542]->CCC1:C(C):C2:C:C:C:C:C:2:O:C:1=O [mass, mass:145.0648, 129.0699]->OCC(O)=NCC(=O)O [mass, mass:141.0699, 129.0699]->O=C1C=CCCC1 [mass, mass:128.062, 129.0699]->C=C1CCC2CCCCC2C1CCC [mass, mass:131.0855, 115.0542]->C=C1CCC2CCCCC2C1CCC [mass:131.0491]->c1ccc(O)cc1 [mass, mass:141.0699, 115.0542]->c1ccc(Cc2ccccc2)cc1 [mass, mass:131.0491, 115.0542]->CC(N=)C(=O)O Motif_264: [mass:147.0804]->CC1=CC(=O)C=CC1C [mass:135.0804]->CC1=CC(=O)C=CC1C [mass:171.0804]->CC1=CC(=O)C=CC1C [mass:161.0961]->CC1=CC(=O)C=CC1C [mass:173.0961]->CCC1=CC(=O)C=CC1C Motif_266: [mass:149.0597]->C(OC(=C)C)(C)(C)C [mass:135.0441]->Oc1ccccc1OC [mass:115.0542]->C:C:C(=O):O:C1:C:C:C:C(:C:1)OCC(O)=NCC [mass:141.0699]->CCC1:C(C):C2:C:C:C:C:C:2:O:C:1=O [mass:128.062]->CCC1:C(C):C2:C:C:C:C:C:2:O:C:1=O [mass, mass:128.062, 115.0542]->CCC1:C(C):C2:C:C:C:C:C:2:O:C:1=O [mass, mass:141.0699, 128.062]->CCC1:C(C):C2:C:C:C:C:C:2:O:C:1=O [mass, mass, mass:141.0699, 128.062, 115.0542]->CCC1:C(C):C2:C:C:C:C:C:2:O:C:1=O [mass, mass:141.0699, 115.0542]->c1ccc(Cc2ccccc2)cc1 [mass:153.0699]->CCN=C(O)COC1:C:C:C2:C:C:C(=O):O:C:2:C:1 Motif_271: [mdiff:56.0626]->C1(Oc2c(c3c(cc2)ccc(=O)o3)CC1)(C)C [mass:147.0804]->CC1=CC(=O)C=CC1C [mass:171.0804]->CC1=CC(=O)C=CC1C [mass, mass:159.0804, 147.0804]->C1CCC2=CC(=O)C=CC2(C)C1 [mass:143.0855]->C#CC1(O)CCC2C3CCC4=CC(=O)CCC4C3CCC21C [mass:155.0855]->C#CC1(O)CCC2C3CCC4=CC(=O)CCC4C3CCC21C [mass, mass:143.0855, 128.062]->C#CC1(O)CCC2C3CCC4=CC(=O)CCC4C3CCC21C [mass:159.0804]->C1=CC(=O)C=CC1C [mass:145.0648]->C1=CC(=O)C=CC1C [mass, mass:147.0804, 145.0648]->C1=CC(=O)C=CC1C [mass, mass:159.0804, 145.0648]->C1=CC(=O)C=CC1C [mass:128.062]->CCC1:C(C):C2:C:C:C:C:C:2:O:C:1=O Motif_274: [mass:147.0804]->CC1=CC(=O)C=CC1C [mass:135.0804]->CC1=CC(=O)C=CC1C [mass:171.0804]->CC1=CC(=O)C=CC1C [mass:161.0961]->CC1=CC(=O)C=CC1C [mass, mass:159.0804, 147.0804]->C1CCC2=CC(=O)C=CC2(C)C1 [mass:185.0961]->N=C(O)CCc1c(C)c2cc3c(C)coc3cc2oc1=O [mass:121.0648]->CC12C=CC(=O)C=C1CCC1C2C(O)CC2(C)C(CCC12)C(=O)CO [mass, mass:147.0804, 121.0648]->CC12C=CC(=O)C=C1CCC1C2C(O)CC2(C)C(CCC12)C(=O)CO [mass:173.0961]->CCC1=CC(=O)C=CC1C [mass, mass:147.0804, 119.0855]->CCC1=CC(=O)C=CC1C [mass:119.0855]->C1=CC(=O)CCC1C [mass:159.0804]->C1=CC(=O)C=CC1C [mass:145.0648]->C1=CC(=O)C=CC1C [mass, mass:147.0804, 145.0648]->C1=CC(=O)C=CC1C [mass, mass:159.0804, 145.0648]->C1=CC(=O)C=CC1C [mass, mass:135.0804, 121.0648]->CC(=O)C1C(C)CC2C3CCC4=CC(=O)C=CC4(C)C3C(O)CC21C Motif_279: [mass:143.0855]->C#CC1(O)CCC2C3CCC4=CC(=O)CCC4C3CCC21C [mass:155.0855]->C#CC1(O)CCC2C3CCC4=CC(=O)CCC4C3CCC21C [mass, mass:143.0855, 128.062]->C#CC1(O)CCC2C3CCC4=CC(=O)CCC4C3CCC21C [mass:145.1012]->C1=CC(=O)CCC1C [mass, mass:145.1012, 143.0855]->C1(=CC(=O)CCC1C)CC [mass:141.0699]->CCC1:C(C):C2:C:C:C:C:C:2:O:C:1=O [mass:128.062]->CCC1:C(C):C2:C:C:C:C:C:2:O:C:1=O [mass, mass:141.0699, 128.062]->CCC1:C(C):C2:C:C:C:C:C:2:O:C:1=O Motif_282: [mass:161.0597]->C1(Oc2c(c3c(cc2)ccc(=O)o3)CC1)(C)C [mass:147.0804]->CC1=CC(=O)C=CC1C [mass:161.0961]->CC1=CC(=O)C=CC1C [mass, mass:159.0804, 147.0804]->C1CCC2=CC(=O)C=CC2(C)C1 [mass:173.0961]->CCC1=CC(=O)C=CC1C [mass:159.0804]->C1=CC(=O)C=CC1C [mass:145.0648]->C1=CC(=O)C=CC1C [mass, mass:147.0804, 145.0648]->C1=CC(=O)C=CC1C [mass, mass:159.0804, 145.0648]->C1=CC(=O)C=CC1C [mass:103.0542]->CCc1ccccc1 [mass, mass:107.0491, 103.0542]->CCNCC(O)CO [mass:107.0491]->c1cccc(c1)OC [mass:133.0648]->COC1:C:C:C:C(:C:1)CCN [mass, mass:131.0491, 103.0542]->C(=O)CCc1ccccc1 [mass:131.0491]->c1ccc(O)cc1 Motif_304: [mass:160.0757]->N(CC(Cn1c(=O)cccc1)C)(C)C [mass:132.0444]->N(CC(Cn1c(=O)cccc1)C)(C)C [mass:117.0573]->c1(=O)cccc[nH]1 [mass:172.0757]->O=C1:C:C:C:C2C3CC(CN(C3)C(O)=NC3:C:C:C:C:C:3)CN:2:1 [mdiff:57.0215]->CN=C(O)CO [mdiff:71.0371]->CC(=O)N1CCC(CC1)C(=N)O [mass:104.0495]->C(=)N1CC2CC(C1)c1cccc(=O)n1C2 Motif_314: [mass:158.06]->CC1=C[N]([H])C2=C1C=CC=C2 [mass:146.06]->C(C(=O)O)(N=CO)Cc1c2c(cccc2)[nH]c1 [mass, mass:132.0808, 130.0651]->C(Cc1c2c(cccc2)[nH]c1)(C=O)N [mass:132.0808]->C(Cc1c[nH]c2ccccc12)N= [mass:130.0651]->C(O)=NCCc1c[nH]c2ccccc12 [mass:104.0495]->C(=)N1CC2CC(C1)c1cccc(=O)n1C2 Motif_318: [mass:143.0855]->C#CC1(O)CCC2C3CCC4=CC(=O)CCC4C3CCC21C [mass, mass:143.0855, 131.0855]->C#CC1(O)CCC2C3CCC4=CC(=O)CCC4C3CCC21C [mass, mass:145.1012, 119.0855]->C#CC1(O)CCC2C3CCC4=CC(=O)CCC4C3CCC21C [mass, mass:143.0855, 128.062]->C#CC1(O)CCC2C3CCC4=CC(=O)CCC4C3CCC21C [mass:145.1012]->C1=CC(=O)CCC1C [mass:119.0855]->C1=CC(=O)CCC1C [mass, mass:145.1012, 131.0855]->C1=CC(=O)CCC1C [mass:135.0804]->CC1=CC(=O)C=CC1C [mass:161.0961]->CC1=CC(=O)C=CC1C [mass:131.0855]->CC12CC=C3C(CCC4CCCCC34C)C1CCC2 [mass, mass:131.0855, 119.0855]->CC12CC=C3C(CCC4CCCCC34C)C1CCC2 [mass, mass:143.0855, 119.0855]->C1(=CC(=O)CCC1C)CC [mass, mass:145.1012, 143.0855]->C1(=CC(=O)CCC1C)CC [mass:133.1012]->C1(=CC(=O)CCC1C)CC [mass, mass:133.1012, 119.0855]->C1(=CC(=O)CCC1C)CC [mass, mass:107.0855, 119.0855]->C1(=CC(=O)CCC1C)CC [mass:159.0804]->C1=CC(=O)C=CC1C [mass:107.0855]->CC1=CC(=O)CCC1C [mass:115.0542]->C:C:C(=O):O:C1:C:C:C:C(:C:1)OCC(O)=NCC [mass:141.0699]->CCC1:C(C):C2:C:C:C:C:C:2:O:C:1=O [mass:128.062]->CCC1:C(C):C2:C:C:C:C:C:2:O:C:1=O [mass, mass:128.062, 115.0542]->CCC1:C(C):C2:C:C:C:C:C:2:O:C:1=O [mass, mass:141.0699, 128.062]->CCC1:C(C):C2:C:C:C:C:C:2:O:C:1=O [mass, mass:143.0855, 115.0542]->CCC1:C(C):C2:C:C:C:C:C:2:O:C:1=O [mass, mass, mass:141.0699, 128.062, 115.0542]->CCC1:C(C):C2:C:C:C:C:C:2:O:C:1=O [mass, mass:141.0699, 115.0542]->c1ccc(Cc2ccccc2)cc1 [mass, mass:131.0855, 115.0542]->C=C1CCC2CCCCC2C1CCC Motif_324: [mass:105.0335]->C(C=O)(C)CCC [mass:159.0804]->C1=CC(=O)C=CC1C [mass:149.0597]->C(OC(=C)C)(C)(C)C [mass:131.0491]->c1ccc(O)cc1 [mass:157.0648]->C:C:C:C:C:C:C:CC1:C:C:C(O):C:C:1 Motif_325: [mass:147.0804]->CC1=CC(=O)C=CC1C [mass:119.0855]->C1=CC(=O)CCC1C [mass, mass:147.0804, 119.0855]->CCC1=CC(=O)C=CC1C [mass:145.0648]->C1=CC(=O)C=CC1C [mass, mass:147.0804, 145.0648]->C1=CC(=O)C=CC1C [mass:107.0491]->c1cccc(c1)OC [mass:131.0491]->c1ccc(O)cc1 Motif_331: [mass:145.1012]->C1=CC(=O)CCC1C [mass:119.0855]->C1=CC(=O)CCC1C [mass, mass:145.1012, 131.0855]->C1=CC(=O)CCC1C [mass:131.0855]->CC12CC=C3C(CCC4CCCCC34C)C1CCC2 [mass, mass:131.0855, 119.0855]->CC12CC=C3C(CCC4CCCCC34C)C1CCC2 [mass, mass:145.1012, 119.0855]->C#CC1(O)CCC2C3CCC4=CC(=O)CCC4C3CCC21C [mass, mass:119.0855, 129.0699]->C#CC1(O)CCC2C3CCC4=CC(=O)CCC4C3CCC21C [mass, mass:131.0855, 129.0699]->C#CC1(O)CCC2C3CCC4=CC(=O)CCC4C3CCC21C [mass:133.1012]->C1(=CC(=O)CCC1C)CC [mass, mass:133.1012, 119.0855]->C1(=CC(=O)CCC1C)CC [mass, mass:107.0855, 119.0855]->C1(=CC(=O)CCC1C)CC [mass:107.0855]->CC1=CC(=O)CCC1C [mass:129.0699]->CC1=CC(=CCC2CCCCC2C)CCC1 Motif_338: [mass:173.0961]->CCC1=CC(=O)C=CC1C [mass:143.0855]->C#CC1(O)CCC2C3CCC4=CC(=O)CCC4C3CCC21C [mass, mass:143.0855, 129.0699]->C#CC1(O)CCC2C3CCC4=CC(=O)CCC4C3CCC21C [mass, mass:143.0855, 128.062]->C#CC1(O)CCC2C3CCC4=CC(=O)CCC4C3CCC21C [mass:145.1012]->C1=CC(=O)CCC1C [mass:159.0804]->C1=CC(=O)C=CC1C [mass, mass:145.1012, 143.0855]->C1(=CC(=O)CCC1C)CC [mass:171.0804]->CC1=CC(=O)C=CC1C [mass:129.0699]->CC1=CC(=CCC2CCCCC2C)CCC1 [mass:141.0699]->CCC1:C(C):C2:C:C:C:C:C:2:O:C:1=O [mass:128.062]->CCC1:C(C):C2:C:C:C:C:C:2:O:C:1=O [mass, mass:141.0699, 128.062]->CCC1:C(C):C2:C:C:C:C:C:2:O:C:1=O [mass, mass:141.0699, 129.0699]->O=C1C=CCCC1 [mass, mass:128.062, 129.0699]->C=C1CCC2CCCCC2C1CCC [mass:153.0699]->CCN=C(O)COC1:C:C:C2:C:C:C(=O):O:C:2:C:1 Motif_361: [mass:117.0573]->c1(=O)cccc[nH]1 [mass:134.06]->N(CC(Cn1c(=O)cccc1)C)(C)C [mass:149.0597]->C(OC(=C)C)(C)(C)C [mass:107.0491]->c1cccc(c1)OC [mdiff:71.0371]->CC(=O)N1CCC(CC1)C(=N)O [mdiff:31.0422]->CC1CCC(N)CC1 Motif_378: [mass:157.1012]->C1=CC(=O)CCC1C [mass:145.1012]->C1=CC(=O)CCC1C [mass, mass:145.1012, 131.0855]->C1=CC(=O)CCC1C [mass:185.0961]->N=C(O)CCc1c(C)c2cc3c(C)coc3cc2oc1=O [mass:143.0855]->C#CC1(O)CCC2C3CCC4=CC(=O)CCC4C3CCC21C [mass, mass:143.0855, 131.0855]->C#CC1(O)CCC2C3CCC4=CC(=O)CCC4C3CCC21C [mass:155.0855]->C#CC1(O)CCC2C3CCC4=CC(=O)CCC4C3CCC21C [mass:131.0855]->CC12CC=C3C(CCC4CCCCC34C)C1CCC2 [mass, mass:145.1012, 143.0855]->C1(=CC(=O)CCC1C)CC [mass:107.0855]->CC1=CC(=O)CCC1C Motif_387: [mass:143.0855]->C#CC1(O)CCC2C3CCC4=CC(=O)CCC4C3CCC21C [mass, mass:143.0855, 129.0699]->C#CC1(O)CCC2C3CCC4=CC(=O)CCC4C3CCC21C [mass, mass:143.0855, 128.062]->C#CC1(O)CCC2C3CCC4=CC(=O)CCC4C3CCC21C [mass:144.0808]->C(O)=NCCc1c[nH]c2ccccc12 [mass:175.0754]->COc1cc(C)cc2oc(=O)ccc12 [mass:129.0699]->CC1=CC(=CCC2CCCCC2C)CCC1 [mass:115.0542]->C:C:C(=O):O:C1:C:C:C:C(:C:1)OCC(O)=NCC [mass:128.062]->CCC1:C(C):C2:C:C:C:C:C:2:O:C:1=O [mass, mass:129.0699, 115.0542]->CCC1:C(C):C2:C:C:C:C:C:2:O:C:1=O [mass, mass:128.062, 115.0542]->CCC1:C(C):C2:C:C:C:C:C:2:O:C:1=O [mass, mass:143.0855, 115.0542]->CCC1:C(C):C2:C:C:C:C:C:2:O:C:1=O [mass, mass, mass:128.062, 129.0699, 115.0542]->CCC1:C(C):C2:C:C:C:C:C:2:O:C:1=O [mass, mass:128.062, 129.0699]->C=C1CCC2CCCCC2C1CCC Motif_398: [mass:158.06]->CC1=C[N]([H])C2=C1C=CC=C2 [mass:160.0757]->N(CC(Cn1c(=O)cccc1)C)(C)C [mass:134.06]->N(CC(Cn1c(=O)cccc1)C)(C)C [mass:146.06]->C(C(=O)O)(N=CO)Cc1c2c(cccc2)[nH]c1 [mass:172.0757]->O=C1:C:C:C:C2C3CC(CN(C3)C(O)=NC3:C:C:C:C:C:3)CN:2:1 Motif_400: [mass:157.1012]->C1=CC(=O)CCC1C [mass:145.1012]->C1=CC(=O)CCC1C [mass, mass:145.1012, 131.0855]->C1=CC(=O)CCC1C [mass:131.0855]->CC12CC=C3C(CCC4CCCCC34C)C1CCC2 [mass:141.0699]->CCC1:C(C):C2:C:C:C:C:C:2:O:C:1=O [mass:128.062]->CCC1:C(C):C2:C:C:C:C:C:2:O:C:1=O [mass, mass:141.0699, 128.062]->CCC1:C(C):C2:C:C:C:C:C:2:O:C:1=O Motif_419: [mass:134.06]->N(CC(Cn1c(=O)cccc1)C)(C)C [mass:146.06]->C(C(=O)O)(N=CO)Cc1c2c(cccc2)[nH]c1 [mass:155.0855]->C#CC1(O)CCC2C3CCC4=CC(=O)CCC4C3CCC21C [mass:145.0648]->C1=CC(=O)C=CC1C [mass:165.0699]->cc-c1ccccc1 [mass:128.062]->CCC1:C(C):C2:C:C:C:C:C:2:O:C:1=O [mass:157.0648]->C:C:C:C:C:C:C:CC1:C:C:C(O):C:C:1 [mass:153.0699]->CCN=C(O)COC1:C:C:C2:C:C:C(=O):O:C:2:C:1 [mass:127.0542]->CCc1c[nH]c2ccccc12 Motif_423: [mass:105.0335]->C(C=O)(C)CCC [mass:103.0542]->CCc1ccccc1 [mdiff:30.047]->CC1=CC(=CCC2CCCCC2C)CCC1 [mass:128.062]->CCC1:C(C):C2:C:C:C:C:C:2:O:C:1=O [mass:133.0648]->COC1:C:C:C:C(:C:1)CCN [mass, mass:128.062, 103.0542]->c1ccc(Cc2ccccc2)cc1 Motif_431: [mass:148.0757]->N(CC(Cn1c(=O)cccc1)C)(C)C [mass:147.0804]->CC1=CC(=O)C=CC1C [mass, mass:159.0804, 147.0804]->C1CCC2=CC(=O)C=CC2(C)C1 [mass:159.0804]->C1=CC(=O)C=CC1C [mass:145.0648]->C1=CC(=O)C=CC1C [mass, mass:147.0804, 145.0648]->C1=CC(=O)C=CC1C [mass, mass:159.0804, 145.0648]->C1=CC(=O)C=CC1C [mdiff:57.0215]->CN=C(O)CO [mass:115.0542]->C:C:C(=O):O:C1:C:C:C:C(:C:1)OCC(O)=NCC [mass, mass:145.0648, 115.0542]->CC(N=C(O)CO)C(=O)O Motif_457: [mass:158.06]->CC1=C[N]([H])C2=C1C=CC=C2 [mass:160.0757]->N(CC(Cn1c(=O)cccc1)C)(C)C [mass:148.0757]->N(CC(Cn1c(=O)cccc1)C)(C)C [mass:134.06]->N(CC(Cn1c(=O)cccc1)C)(C)C [mass:146.06]->C(C(=O)O)(N=CO)Cc1c2c(cccc2)[nH]c1 [mass:172.0757]->O=C1:C:C:C:C2C3CC(CN(C3)C(O)=NC3:C:C:C:C:C:3)CN:2:1 Motif_463: [mass:143.0855]->C#CC1(O)CCC2C3CCC4=CC(=O)CCC4C3CCC21C [mass, mass:143.0855, 129.0699]->C#CC1(O)CCC2C3CCC4=CC(=O)CCC4C3CCC21C [mass, mass:143.0855, 128.062]->C#CC1(O)CCC2C3CCC4=CC(=O)CCC4C3CCC21C [mass:171.0804]->CC1=CC(=O)C=CC1C [mass:103.0542]->CCc1ccccc1 [mass:129.0699]->CC1=CC(=CCC2CCCCC2C)CCC1 [mass, mass:129.0699, 103.0542]->OCC(O)=NCC(=O)O [mass:128.062]->CCC1:C(C):C2:C:C:C:C:C:2:O:C:1=O [mass, mass:131.0491, 103.0542]->C(=O)CCc1ccccc1 [mass, mass:128.062, 129.0699]->C=C1CCC2CCCCC2C1CCC [mass:131.0491]->c1ccc(O)cc1 [mass, mass:128.062, 103.0542]->c1ccc(Cc2ccccc2)cc1 Motif_479: [mass:117.0573]->c1(=O)cccc[nH]1 [mass:135.0804]->CC1=CC(=O)C=CC1C [mass:107.0855]->CC1=CC(=O)CCC1C [mass:145.0648]->C1=CC(=O)C=CC1C [mass:104.0495]->C(=)N1CC2CC(C1)c1cccc(=O)n1C2 Motif_485: [mass:147.0804]->CC1=CC(=O)C=CC1C [mass:171.0804]->CC1=CC(=O)C=CC1C [mass:161.0961]->CC1=CC(=O)C=CC1C [mass, mass:159.0804, 147.0804]->C1CCC2=CC(=O)C=CC2(C)C1 [mass:185.0961]->N=C(O)CCc1c(C)c2cc3c(C)coc3cc2oc1=O [mass:173.0961]->CCC1=CC(=O)C=CC1C [mass, mass:147.0804, 119.0855]->CCC1=CC(=O)C=CC1C [mass:119.0855]->C1=CC(=O)CCC1C [mass:159.0804]->C1=CC(=O)C=CC1C [mass:145.0648]->C1=CC(=O)C=CC1C [mass, mass:147.0804, 145.0648]->C1=CC(=O)C=CC1C [mass, mass:159.0804, 145.0648]->C1=CC(=O)C=CC1C Motif_493: [mass:173.0961]->CCC1=CC(=O)C=CC1C [mass:135.0804]->CC1=CC(=O)C=CC1C [mass:171.0804]->CC1=CC(=O)C=CC1C [mass:161.0961]->CC1=CC(=O)C=CC1C [mass:159.0804]->C1=CC(=O)C=CC1C [mass:145.0648]->C1=CC(=O)C=CC1C [mass, mass:159.0804, 145.0648]->C1=CC(=O)C=CC1C [mass:129.0699]->CC1=CC(=CCC2CCCCC2C)CCC1 [mass:115.0542]->C:C:C(=O):O:C1:C:C:C:C(:C:1)OCC(O)=NCC [mass, mass:145.0648, 115.0542]->CC(N=C(O)CO)C(=O)O [mass:128.062]->CCC1:C(C):C2:C:C:C:C:C:2:O:C:1=O [mass, mass:129.0699, 115.0542]->CCC1:C(C):C2:C:C:C:C:C:2:O:C:1=O [mass, mass:128.062, 115.0542]->CCC1:C(C):C2:C:C:C:C:C:2:O:C:1=O [mass, mass, mass:128.062, 129.0699, 115.0542]->CCC1:C(C):C2:C:C:C:C:C:2:O:C:1=O [mass, mass:145.0648, 129.0699]->OCC(O)=NCC(=O)O [mass, mass:128.062, 129.0699]->C=C1CCC2CCCCC2C1CCC [mass:157.0648]->C:C:C:C:C:C:C:CC1:C:C:C(O):C:C:1 Motif_494: [mass:147.0804]->CC1=CC(=O)C=CC1C [mass:135.0804]->CC1=CC(=O)C=CC1C [mass:171.0804]->CC1=CC(=O)C=CC1C [mass, mass:159.0804, 147.0804]->C1CCC2=CC(=O)C=CC2(C)C1 [mass:121.0648]->CC12C=CC(=O)C=C1CCC1C2C(O)CC2(C)C(CCC12)C(=O)CO [mass, mass:147.0804, 121.0648]->CC12C=CC(=O)C=C1CCC1C2C(O)CC2(C)C(CCC12)C(=O)CO [mass:105.0335]->C(C=O)(C)CCC [mass:143.0855]->C#CC1(O)CCC2C3CCC4=CC(=O)CCC4C3CCC21C [mass:159.0804]->C1=CC(=O)C=CC1C [mass:145.0648]->C1=CC(=O)C=CC1C [mass, mass:147.0804, 145.0648]->C1=CC(=O)C=CC1C [mass, mass:159.0804, 145.0648]->C1=CC(=O)C=CC1C [mass, mass:135.0804, 121.0648]->CC(=O)C1C(C)CC2C3CCC4=CC(=O)C=CC4(C)C3C(O)CC21C Motif_499: [mass:147.0804]->CC1=CC(=O)C=CC1C [mass:171.0804]->CC1=CC(=O)C=CC1C [mass:185.0961]->N=C(O)CCc1c(C)c2cc3c(C)coc3cc2oc1=O [mass:173.0961]->CCC1=CC(=O)C=CC1C [mass:107.0491]->c1cccc(c1)OC