ID: 84463
SMILES:CC1=C2C(c3c(c(O)cc(CCCCC)c3)OC2(C)C)C2C(C)(O)CCC(=C(C)C(O)=O)C2CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 482.661
CB1 binding score: -15.361
InChIKey:JWPFBLUEUBFPHS-UHFFFAOYSA-N
ID: 84464
SMILES:C=C1C(O)C(O)C(O)C(Oc2ccc3c(c2O)C(=O)c2c(cc(CCCCC)cc2O)OC3(CCC=C(C)C)C)O1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 568.663
CB1 binding score: -13.591
InChIKey:XARMTTGJABKIOU-UHFFFAOYSA-N
ID: 84465
SMILES:c1(O)cc(CCCC)cc2c1C1C(CC=C(CCC=C(C)C)C)(O2)C(C)(C)C(O)C=C1C(CO)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 480.689
CB1 binding score: -15.717
InChIKey:PJCIYJIPJUUGLA-UHFFFAOYSA-N
ID: 84466
SMILES:c1(CCCC)cc2c(c(O)c1)C1C(C(=C)C)CCC1(C)CC2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.47
CB1 binding score: -16.625
InChIKey:JZCQPECYOFGNDT-UHFFFAOYSA-N
ID: 84467
SMILES:O(C1CC(C)(C)C2C1c1c(cc(CCCCCC)cc1O)O2)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.457
CB1 binding score: -15.477
InChIKey:SOCQBMLPGXMFRR-UHFFFAOYSA-N
ID: 84468
SMILES:C(C)CCCc1cc2c(c(O)c1)C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 84469
SMILES:CC1(C)C2(C(=C)CCC1O)CCC(C)(Oc1cc(O)cc(CCCCC)c1)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.548
CB1 binding score: -12.66
InChIKey:ZMOCULMSSVFJBE-UHFFFAOYSA-N
ID: 84470
SMILES:c1c(O)c2c(cc1C)OC(C)(C)c1c(O)cc3c(c12)CC=CC(C)(C)O3
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 352.43
CB1 binding score: -12.522
InChIKey:BNYICBBYQCUAOP-UHFFFAOYSA-N
ID: 84471
SMILES:C1(C)(C)Oc2c(c(O)ccc2O)C2C1CCC(CO)=C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 276.332
CB1 binding score: -16.344
InChIKey:LJGCVIBASUHQIH-UHFFFAOYSA-N
ID: 84472
SMILES:C1C(C(C)=C)C(c2c(O)cc(CCCC[N+](C)(C)C)cc2)CC(C)=C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.547
CB1 binding score: -17.376
InChIKey:DMDVWOTWOIHQIC-UHFFFAOYSA-O
ID: 84473
SMILES:C(Cc1cc(O)c2c(c1)OC(C)(C)C1C2C=C(C)CC1)C=C(C)C(=O)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.462
CB1 binding score: -17.426
InChIKey:GNEIVKWMGNDABL-UHFFFAOYSA-N
ID: 84474
SMILES:O(C)c1c(O)c(OC)c(C)c(C2C(C(=C)C)CC(O)C(C)=C2)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.413
CB1 binding score: -16.251
InChIKey:ZRNUQRJGZFOZNB-UHFFFAOYSA-N
ID: 84475
SMILES:C1C(CO)CC2C(C)(C)CC1c1c(O)cc(CCC)cc1O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.43
CB1 binding score: -17.193
InChIKey:BXRYRMWCPYMUML-UHFFFAOYSA-N
ID: 84476
SMILES:O=C(CCC(O)(C)C)c1cc(O)c(C2C=C(C)CCC2C(=C)C)c(O)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -15.18
InChIKey:JOMQRZVLDJZBNF-UHFFFAOYSA-N
ID: 84477
SMILES:CC12C3(c4c(cc(CCCCC)cc4O1)O2)COC(C(C)(O)CCC=C(C)C)C=C3
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 412.57
CB1 binding score: -16.969
InChIKey:WYLIJWBMAPTRRN-UHFFFAOYSA-N
ID: 84478
SMILES:c1(CCC)c(C(=O)O)c(O)c(CC=C(CCC=C(C)C)C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.44
CB1 binding score: -19.667
InChIKey:FAVCTJGKHFHFHJ-UHFFFAOYSA-N
ID: 84479
SMILES:Oc1cc2c(c(CC=C(CCC=C(C)CO)C)c1)OC(CO)(C)C2C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -14.337
InChIKey:FZEKGAVSULLQPK-UHFFFAOYSA-N
ID: 84480
SMILES:C1C(C(C)(O)C)OC(c2c(O)cc(CCCCC)cc2O)CC(CO)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 364.482
CB1 binding score: -14.608
InChIKey:FBKOBBCZNSMKHL-UHFFFAOYSA-N
ID: 84481
SMILES:c12cc(CCCCC)cc(O)c1OC(C)(C)C1CCC(O)(C)C21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.457
CB1 binding score: -18.969
InChIKey:JXPGNYUXDHWARV-UHFFFAOYSA-N
ID: 84482
SMILES:C1C2C(c3c(cc(CCCCC)cc3OC)OC2(C)C)CC1C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -16.561
InChIKey:ZPEDKIRUTLEYEN-UHFFFAOYSA-N
ID: 84483
SMILES:c1c2c(cc(CCCCC)c1)OC(C)(C)C1C(OC(C)=O)CC(C)C1C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.522
CB1 binding score: -15.175
InChIKey:LMLUFGPIIINLCV-UHFFFAOYSA-N