ID: 39103
SMILES:C1(C)(O)CCC(C(C)C)C1c1c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 320.473
CB1 binding score: -16.891
InChIKey:VBGLJIFFNSKSNQ-UHFFFAOYSA-N
ID: 39104
SMILES:C12C(=CCC(=C)C1C)c1c(cc(CCCCC)c(C(OC)=O)c1O)OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.516
CB1 binding score: -15.67
InChIKey:XQSAEDYPADPAEZ-UHFFFAOYSA-N
ID: 39105
SMILES:CCCCCc1cc2c(c(O)c1)C1C(C(C)(O)C)CCC(C)C1CC=C(C)C2O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.603
CB1 binding score: -12.543
InChIKey:WPLVZVFHLNWUDV-UHFFFAOYSA-N
ID: 39106
SMILES:CC(COc1c2c(ccc1O)OC(C)(C)C1C2CC(C)=CC1)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -14.089
InChIKey:YPZUOKCUISHPKD-UHFFFAOYSA-N
ID: 39107
SMILES:C(CCCC)CCc1cc2c(c(O)c1)C1C(C(C)(C)O2)CC(OC(=O)C)C(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.559
CB1 binding score: -16.855
InChIKey:UHHPGHUIAHNVFO-UHFFFAOYSA-N
ID: 39108
SMILES:c1c(O)c2c3c(c1)OC(C)(C)C1CC=C(C)C1CC2c1cc(O)c(C(C)=C)cc31
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.507
CB1 binding score: -15.484
InChIKey:RVNOORSPBLUZJU-UHFFFAOYSA-N
ID: 39109
SMILES:C12C(O1)c1c(O)cc(CCCCC)cc1OC2(C)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 262.349
CB1 binding score: -19.296
InChIKey:GEMPDHCIWOATES-UHFFFAOYSA-N
ID: 39110
SMILES:c12c(O)cc3c(c1C(c1c(O)c(C)cc(O)c1)C=CC3C)OC(C)(C)C1C2C=C(C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 432.56
CB1 binding score: -15.67
InChIKey:FORWRAMETNCZFE-UHFFFAOYSA-N
ID: 39111
SMILES:c1c2c(cc(CCCCC)c1)OC(C)(C)C1=CCC(C)=CC1C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 310.481
CB1 binding score: -13.688
InChIKey:VZUXSHWJOWQGBH-UHFFFAOYSA-N
ID: 39112
SMILES:Oc1c(O)c(C(=O)OC)cc2c1OC(C)(C)C1CCC(C)=CC12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.369
CB1 binding score: -15.404
InChIKey:YEFOMQOUXFAWLR-UHFFFAOYSA-N
ID: 39113
SMILES:CC1(C)Oc2cc(CCCCC)cc(O)c2C2C1CCC(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 39114
SMILES:C(CC)CCc1c(O)c(C2C=C(C)CCC2C(=C)C)c2c(cccc2)c1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 364.529
CB1 binding score: -15.467
InChIKey:QDHWWSNXJSGYBD-UHFFFAOYSA-N
ID: 39115
SMILES:C1CC=C(C)C2(OO)C1C(C)(C)Oc1c2cc(O)c(C)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 290.359
CB1 binding score: -17.681
InChIKey:QUFXGLNUJWUPCG-UHFFFAOYSA-N
ID: 39116
SMILES:CC(=CCCC1(C)Oc2c(c(O)cc(CCCCCCCCC=CCCCC)c2)C2CCC(C)=CC21)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 506.815
CB1 binding score: -14.8
InChIKey:LLSVRPKEKZOTNU-UHFFFAOYSA-N
ID: 39117
SMILES:C(c1ccc2c(c1)C=CC(C)(CCC=C(C)C)O2)CCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 284.443
CB1 binding score: -16.055
InChIKey:FGVCTSCNLYKIAY-UHFFFAOYSA-N
ID: 39118
SMILES:CC1(C)C2C(CBr)(CCC1Br)Oc1c(c(O)cc(CCCCC)c1)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 474.277
CB1 binding score: -15.111
InChIKey:SHBQULVUKBASRI-UHFFFAOYSA-N
ID: 39119
SMILES:C1C(CC=C(C)C)C2(c3c(cc(CCCCC)cc3O)OC2(C)C)CC(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.604
CB1 binding score: -13.249
InChIKey:GIXKKSRCVVUNJE-UHFFFAOYSA-N
ID: 39120
SMILES:C1(C(=C)C)C(c2c(O)cc(CCCC)cc2O)C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -19.739
InChIKey:WBRXESQKGXYDOL-UHFFFAOYSA-N
ID: 39121
SMILES:C1(C)C2(C)Oc3c(c(O)cc(CCCCCO)c3)C(O2)C1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 292.375
CB1 binding score: -16.211
InChIKey:XRLATQQGUJPXSQ-UHFFFAOYSA-N
ID: 39122
SMILES:C12(C)CCC3C(C)(C)Oc4cc(CCCCC)cc(O)c4C3C1O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -19.791
InChIKey:VSQGBNUBIDZRPJ-UHFFFAOYSA-N
ID: 39123
SMILES:C1CC(C)=CC(c2ccc(CCCCC)cc2)C(C(=C)C)CC(O)C(C)=C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 366.589
CB1 binding score: -13.759
InChIKey:SYILBSHDVDXTTI-UHFFFAOYSA-N