ID: 105694
SMILES:C12C(C(C)(C)Oc3cc(CCCCC)cc(O)c3C1)CCC2(C)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -18.385
InChIKey:XGBLUBYIKPYOCW-UHFFFAOYSA-N
ID: 105695
SMILES:C1(C)(C)Oc2cc(O)cc(C)c2C(=O)C1C1C(=Cc2ccccc2)OC(C)(C)C(O)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 422.521
CB1 binding score: -15.226
InChIKey:BHRWIBIWUSHHFR-UHFFFAOYSA-N
ID: 105696
SMILES:c1(C(C)C)cc(O)c2c(c1)OC(C)(C)C1C2CC(C)=CC1O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.414
CB1 binding score: -15.412
InChIKey:AYNSCPAURXCYEI-UHFFFAOYSA-N
ID: 105697
SMILES:C(C(=C)C)(=O)OC1CC(C(C)=C)C2c3c(cc(CCCCC)cc3O)OC(C)(CCC2C(C)=C)O1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 482.661
CB1 binding score: -16.179
InChIKey:KASOHQWGGHTNJQ-UHFFFAOYSA-N
ID: 105698
SMILES:C1(O)C2=C(C(=O)C(O)=C1C)C(C)(C)Oc1c2c(O)cc(CCCCC)c1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.434
CB1 binding score: -15.367
InChIKey:BRZOYXMPOGYVEV-UHFFFAOYSA-N
ID: 105699
SMILES:c1(O)cc(CCCCC)cc2c1C1CC(C)(CCC=C(C)C)CC=C(CC2)C1=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 394.599
CB1 binding score: -15.242
InChIKey:UKEFAASIYRHEPN-UHFFFAOYSA-N
ID: 105700
SMILES:C1(O)CC2(C)Oc3c(c(O)cc(CCCCC)c3)CC2C1(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.457
CB1 binding score: -16.848
InChIKey:KOSJPMAIHKCILU-UHFFFAOYSA-N
ID: 105701
SMILES:CC1(C)Oc2c(c(O)cc(CCc3ccccc3)c2)CC2C(C)(C)CC1C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 364.529
CB1 binding score: -15.744
InChIKey:SUVGTRICBIJQDW-UHFFFAOYSA-N
ID: 105702
SMILES:Brc1c(CC=C(C)CCC=C(C)C)c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 379.382
CB1 binding score: -17.671
InChIKey:USMFYASDWRKLAC-UHFFFAOYSA-N
ID: 105703
SMILES:S(=O)(COc1cc(CCCCC)cc2c1c(O)c1c(c2)OC(C)(C)C=C1)CCC
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 416.583
CB1 binding score: -13.921
InChIKey:RGBCYTUKIZQTKA-UHFFFAOYSA-N
ID: 105704
SMILES:C1(C)(C)C=CC2(C)C(c3c(O)cc(CCCCC)cc3O2)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -14.774
InChIKey:CDANDKREHSQQPT-UHFFFAOYSA-N
ID: 105705
SMILES:C1C(C)=CC(c2c(O)cc(CCCCC)cc2OC)C(C(C)=C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -19.302
InChIKey:IPGGELGANIXRSX-UHFFFAOYSA-N
ID: 105706
SMILES:CC(C(OC)=O)CCCC(C1CCC(C)=CC1c1c(O)cc(CCC)cc1O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 402.575
CB1 binding score: -14.163
InChIKey:XLNCOZIEYFIFQM-UHFFFAOYSA-N
ID: 105707
SMILES:CC(C)(c1ccc2c(c1)C(=O)C1C(CC(=O)C1(OC)C)C(C)(C)O2)CC
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -14.934
InChIKey:RCLOXWPNQSOVNZ-UHFFFAOYSA-N
ID: 105708
SMILES:C(C)(=CCc1c(O)cc(CCCCC)cc1OC)CCC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.512
CB1 binding score: -19.49
InChIKey:KASVLYINZPAMNS-UHFFFAOYSA-N
ID: 105709
SMILES:C1(C)(C)Oc2c(c(O)cc(CCCCC)c2)C=C1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 246.35
CB1 binding score: -20.081
InChIKey:XLSYFQOJMWXOCT-UHFFFAOYSA-N
ID: 105710
SMILES:ClCC(=C(C(=O)OC1C(O)(C(=C)C)C(c2c(O)cc(CCCCC)cc2O)C(C)CC1OC(=O)C)C)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 539.065
CB1 binding score: -16.172
InChIKey:UEXBWEIFFFBKCH-UHFFFAOYSA-N
ID: 105711
SMILES:C1CC(=C)C2C1c1c(cc(CCCCC)cc1OC)OC(C)(C)C=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 340.507
CB1 binding score: -16.14
InChIKey:YWERYCDJXLUNDW-UHFFFAOYSA-N
ID: 105712
SMILES:C(C1C2C(CC(C)=CC2)c2c(cc(CCCCC)cc2O)O1)(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -16.705
InChIKey:VMEHAQRFJVZBLW-UHFFFAOYSA-N
ID: 105713
SMILES:Cc1cc(O)cc(CC(C)C2CCC=C(C)C2CC=C(C)C)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.497
CB1 binding score: -12.401
InChIKey:KHLVQEQWNJLZLY-UHFFFAOYSA-N
ID: 105714
SMILES:C1(C(C)(C)OO)CCC(C)=CC1c1c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 348.483
CB1 binding score: -16.338
InChIKey:YEOLFRVPTUNFAV-UHFFFAOYSA-N