ID: 79024
SMILES:CC1CCC2=C(c3c(cc(CCCCC)c(C(=O)O)c3O)OC2(C)C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -16.015
InChIKey:QTYNFLQRTQFUDT-UHFFFAOYSA-N
ID: 79025
SMILES:CC1(C)Oc2c(c(O)cc(CCCC)c2)C(=O)C12CCCC2C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -15.929
InChIKey:PKLHXKQBUUYOKN-UHFFFAOYSA-N
ID: 79026
SMILES:C=C1CC2(c3c(cc(CCCCC)cc3O)OC2(C)C)c2c(cc(CCCCC)cc2O)OC1CC(C)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 518.738
CB1 binding score: -13.229
InChIKey:KBIZOFAPURKXNJ-UHFFFAOYSA-N
ID: 79027
SMILES:c1(CCO)c(C)cc(O)c2c1OC(C)(C)C1C2C(O)C(C)(O)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 336.428
CB1 binding score: -15.395
InChIKey:ZFDCHELXPMOXJA-UHFFFAOYSA-N
ID: 79028
SMILES:CC(=C1C(c2c(O)cc(CCCCC)cc2)CC(C)=CCC1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.497
CB1 binding score: -17.483
InChIKey:YUJJLGBMSTYCGA-UHFFFAOYSA-N
ID: 79029
SMILES:CC1(C)Oc2cc(O)cc(C)c2C2C1CC=C(C(OC)=O)C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.37
CB1 binding score: -16.052
InChIKey:NLPCUOHCJSNALR-UHFFFAOYSA-N
ID: 79030
SMILES:c1(O)cc(CCCC)cc2c1CC(O)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 250.338
CB1 binding score: -19.121
InChIKey:CVXVLENENUQXCN-UHFFFAOYSA-N
ID: 79031
SMILES:OC(=O)C1=C(C)OC(C)(C)C2CCC(C)=C(CCC(CC)C)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 320.473
CB1 binding score: -14.669
InChIKey:JRRZDNNPXFBJEE-UHFFFAOYSA-N
ID: 79032
SMILES:C(C1=CC2C(C(C)(C)Oc3cc(CCCCC)cc(O)c31)CC2)(c1ccccc1)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 404.55
CB1 binding score: -14.935
InChIKey:ZTOUJCAIIGSYBP-UHFFFAOYSA-N
ID: 79033
SMILES:C(CC=C(C#CC=C(C)C)C)C(C)=CCc1c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 380.572
CB1 binding score: -15.929
InChIKey:UJNJDSVNWVZIKM-UHFFFAOYSA-N
ID: 79034
SMILES:c1(CCC)cc(O)c2c(c1)OC(C)(C)C1CC=C(C)CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -19.805
InChIKey:CDBDULHNWQRYSY-UHFFFAOYSA-N
ID: 79035
SMILES:c1(CCCC)cc(C2C=C(C)CCC2C(=C)C)cc(CC=C)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 308.509
CB1 binding score: Not available
InChIKey:DSJBPYYEWWNYCJ-UHFFFAOYSA-N
ID: 79036
SMILES:C1=C(C)CCC2C(C)(C)Oc3ccc(O)cc3C21
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 244.334
CB1 binding score: -20.067
InChIKey:OBJJEVJNCDBGOD-UHFFFAOYSA-N
ID: 79037
SMILES:C(CC(C)=CCc1c(O)cc(CCCCC)cc1O)OC(C=C(C)C)=O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -15.894
InChIKey:OQXHWTVNKWCFFJ-UHFFFAOYSA-N
ID: 79038
SMILES:C(=CCC(C)(C)O)C1(CC=C(C)C)Oc2c(c(O)cc(CCCCC)c2)C1=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.532
CB1 binding score: -16.859
InChIKey:ZZPCETMNKVOWSO-UHFFFAOYSA-N
ID: 79039
SMILES:CC1(C)C2CCC(C)=CC2c2c(c(C(OC)=O)cc(O)c2O)O1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.369
CB1 binding score: -15.609
InChIKey:OAAAVTXXXLGGCU-UHFFFAOYSA-N
ID: 79040
SMILES:C12c3c(cc(CCCCC)cc3O)OC(C)(C)C1CC=C(C)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 79041
SMILES:c1(OC)c(CCCSC)c(O)c(C2C(C(C)=C)CCC(C)=C2)c(O)c1C=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 390.545
CB1 binding score: -13.957
InChIKey:IAHIQEGJGUIZJG-UHFFFAOYSA-N
ID: 79042
SMILES:C1=CC(C)(C)CCC2(C)Oc3cc(CCCCC)cc(O)c3C2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -13.429
InChIKey:RIBQTSXPZJQKJV-UHFFFAOYSA-N
ID: 79043
SMILES:CC1C(c2c(O)cc(CCCC)cc2O)OC(C)(C)C1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 278.392
CB1 binding score: -12.313
InChIKey:MEXYYYXGPAQHHO-UHFFFAOYSA-N
ID: 79044
SMILES:C1(O)C(C)=CC2c3c(O)cc(CCCCC)cc3OC(C)(C)C2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -19.534
InChIKey:INKUWBOHCFHXTJ-UHFFFAOYSA-N