ID: 57751
SMILES:C(CCCc1cc(O)c2c(c1)OC(C)(C)C1CCC(C)=CC21)CCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.523
CB1 binding score: -18.354
InChIKey:OJTMRZHYTZMJKX-UHFFFAOYSA-N
ID: 57752
SMILES:Oc1c(O)c2c(cc1)OC(C)(C)C1CC=C(C)C(O)C21
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 276.332
CB1 binding score: -16.252
InChIKey:QYSLXWXLDSFGED-UHFFFAOYSA-N
ID: 57753
SMILES:Oc1c(O)c2c(cc1)OC(C)(C)C1CC=C(C)CC21
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 260.333
CB1 binding score: -16.985
InChIKey:MYRUYLQSQBCOMO-UHFFFAOYSA-N
ID: 57754
SMILES:C(COC(=O)C)C1CC(C(C)C)C(c2c(O)cc(CCCCC=CCO)cc2O)C=C1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 444.612
CB1 binding score: -14.482
InChIKey:MJRRYSYEZIANIJ-UHFFFAOYSA-N
ID: 57755
SMILES:C1(CO)=CC2c3c(c(O)c(O)c(C(C)CCCCCC)c3O)OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 404.547
CB1 binding score: -14.157
InChIKey:USOVJZCKWOMTIS-UHFFFAOYSA-N
ID: 57756
SMILES:CC1=CC2C(c3c(cc(CCCCC)cc3O)O2)C(C(C)C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -16.657
InChIKey:NVCDSOXGOOONIR-UHFFFAOYSA-N
ID: 57757
SMILES:C1=C2C(CCC(C)C2)C(C)(C)Oc2cc(CCCCC)c(C(=O)O)cc21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.506
CB1 binding score: -16.245
InChIKey:ZRDCHPNWURWEJM-UHFFFAOYSA-N
ID: 57758
SMILES:C(C(C)C)CCc1cc2c(c(O)c1)C1(C)CCC(C)=C(C)C1CC2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.524
CB1 binding score: -15.467
InChIKey:VNKOWPGPHGBWKJ-UHFFFAOYSA-N
ID: 57759
SMILES:C(c1ccc2c(c1)CC1C(C(C)(C)O2)CCC(C)=C1)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 270.416
CB1 binding score: -17.217
InChIKey:UWOGRRRYVVOVJC-UHFFFAOYSA-N
ID: 57760
SMILES:Oc1c(C(=O)C(C(CC)C)O)c2c(c(OC)c1)C1C(CCC(C)=C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.504
CB1 binding score: -15.396
InChIKey:YQCKDRROHMTVIC-UHFFFAOYSA-N
ID: 57761
SMILES:c1(CCc2cc(O)c(C3C(C(C)=C)CCC(C)=C3)c(O)c2)ccc(O)c(O)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 380.484
CB1 binding score: -18.486
InChIKey:FDFDTELOCMXKRH-UHFFFAOYSA-N
ID: 57762
SMILES:C1CC(C(C)C)C2C3Oc4c(c(O)cc(CCCCC)c4)C3C2(O)C1CO
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.521
CB1 binding score: -15.519
InChIKey:PZFKDVFEJBMDOM-UHFFFAOYSA-N
ID: 57763
SMILES:C(CC)CCc1cc(O)c2c(c1)OC(C)(CCC=C(C)C)C=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.933
InChIKey:UVOLYTDXHDXWJU-UHFFFAOYSA-N
ID: 57764
SMILES:C12(c3c(cc(CCCCC)cc3O)OC1(C)C)C=C(C)CCC2=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -16.015
InChIKey:KGKFYVMHWOZNQO-UHFFFAOYSA-N
ID: 57765
SMILES:OC1Oc2cc(CCCCC)cc(O)c2C=C1C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 248.322
CB1 binding score: -16.713
InChIKey:DYLUBVXPAKZOOI-UHFFFAOYSA-N
ID: 57766
SMILES:c1(CCCCC)cc2c(c(O)c1)CC1CC(CO)(O)CCC1C2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.511
CB1 binding score: -11.766
InChIKey:QUUXJKCAKYQLSS-UHFFFAOYSA-N
ID: 57767
SMILES:C(Cc1cc(O)c(CC=C(C)CCC=C(C)C)c(O)c1)NC
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 303.446
CB1 binding score: -17.894
InChIKey:JLGPLGOEYPDBJB-UHFFFAOYSA-N
ID: 57768
SMILES:C(CCC)CCc1cc(O)c2c(c1)OC(C)(C)C1OC(C)(CCC=C(C)C)C(C2)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 414.63
CB1 binding score: -15.265
InChIKey:GHLZEMKWOLSPQJ-UHFFFAOYSA-N
ID: 57769
SMILES:C1(C)(C)CC2c3c(O)c(C(=O)O)c(CCCCC)cc3OC(CCCC(C)(C)O)(C2)C1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 446.628
CB1 binding score: -17.263
InChIKey:HUHAZCQWPOFFRI-UHFFFAOYSA-N
ID: 57770
SMILES:CC1c2c(c(C)cc(C)c2)-c2c(cc(CCCCC)cc2O)O1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 310.437
CB1 binding score: -18.379
InChIKey:GKSBQQQIOANKLX-UHFFFAOYSA-N
ID: 57771
SMILES:C(=CCCC(C)=CCc1c(O)c2c(c(C(O)CCCC)c1O)OC(C)(C)C1CCC(C)C2C1)(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 484.721
CB1 binding score: -15.324
InChIKey:ZXKKAHLUQLIWDZ-UHFFFAOYSA-N