ID: 113212
SMILES:c1c(CCCCC)cc2c(c1C1C(C(C)=C)CCC(C)=C1)CC(CO)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 396.615
CB1 binding score: -15.717
InChIKey:IGMHTHMBCNJAFL-UHFFFAOYSA-N
ID: 113213
SMILES:C(=O)(c1c(O)c2c(cc1CCC)OC(C)(C)C1C2C=C(C)CC1)OC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -16.963
InChIKey:YMIHGJLZLIVMJF-UHFFFAOYSA-N
ID: 113214
SMILES:C12CCC(O)(C)C(c3c(O)cc(CCCCC)cc3O)C1C(C=C(C)C)OC2=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 402.531
CB1 binding score: -15.659
InChIKey:LVNBCOMTPXHSTL-UHFFFAOYSA-N
ID: 113215
SMILES:CC1=CC2C(C(C)(C)Oc3c2c(O)cc(CCCCCCCC)c3)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.55
CB1 binding score: -19.71
InChIKey:SFWRRSGOJSILSQ-UHFFFAOYSA-N
ID: 113216
SMILES:C1(c2ccc(O)cc2)Oc2cc(CCCCCC)cc(O)c2C2C=C(C)CCC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 392.539
CB1 binding score: -16.407
InChIKey:XIXFMMKCDWJRPT-UHFFFAOYSA-N
ID: 113217
SMILES:C(CCC(C)=CCOc1c(C)cc(O)c(C(C(=O)C)C(O)=O)c1)=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.45
CB1 binding score: -15.974
InChIKey:IFNPWVYGPIWPSA-UHFFFAOYSA-N
ID: 113218
SMILES:C(C)(C1C(c2c(O)cc(CCC)cc2O)CC(C)CC1)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 290.447
CB1 binding score: -19.319
InChIKey:VNFNICPIQJPBJY-UHFFFAOYSA-N
ID: 113219
SMILES:Oc1c(CC=C(C)CCC=C(C)C)c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.666
InChIKey:QXACEHWTBCFNSA-UHFFFAOYSA-N
ID: 113220
SMILES:C(C)CCCc1cc(O)c(C2C(C(C)=C)CCC(C)=C2)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.427
InChIKey:QHMBSVQNZZTUGM-UHFFFAOYSA-N
ID: 113221
SMILES:CC12CCC(C)=CC1c1c(O)cc(CCCCC)cc1O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -18.448
InChIKey:RFZWOPLSMYHWGF-UHFFFAOYSA-N
ID: 113222
SMILES:C(CC1(C)Oc2c(C)cc(O)cc2C=C1)S(=O)(=O)CC(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 324.442
CB1 binding score: -14.134
InChIKey:FTNPAKXTNIXYOT-UHFFFAOYSA-N
ID: 113223
SMILES:C(CCCc1cc(O)c(C2C=C(C)CCC2C(C)=C)c(O)c1)CCCCCCCCCCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 468.766
CB1 binding score: -19.191
InChIKey:SUCOEFWYSRQSFE-UHFFFAOYSA-N
ID: 113224
SMILES:Oc1cc(CCC)cc2c1C1C(CCC(CO)=C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.414
CB1 binding score: -17.9
InChIKey:UWBCYGUAEGZJRC-UHFFFAOYSA-N
ID: 113225
SMILES:Oc1cc(CCCCC)cc2c1C1C(C(C)(C)O2)CC=C(COC(C)=O)C1=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.488
CB1 binding score: -13.644
InChIKey:VTTLAXIGSOSOFO-UHFFFAOYSA-N
ID: 113226
SMILES:CC(C)C1(C)C(c2c(O)cc(CC)cc2O)C(C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 276.42
CB1 binding score: Not available
InChIKey:WQNFXDLXSAZXDQ-UHFFFAOYSA-N
ID: 113227
SMILES:C(C)N(C)C1C2C(C)(Oc3cc(C)cc(O)c32)CCC1C(C)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 315.457
CB1 binding score: -18.308
InChIKey:DXSMHHOIHYOHST-UHFFFAOYSA-N
ID: 113228
SMILES:C(Cc1cc(O)c(C2(C)CCC(CO)=C2C)c(O)c1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 276.376
CB1 binding score: -14.468
InChIKey:CJROPEULPXNISW-UHFFFAOYSA-N
ID: 113229
SMILES:Brc1c(O)c(C(C)C)cc2c1C1C=C(C)CCC1C(C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 365.311
CB1 binding score: -11.288
InChIKey:BCWXGCDYKLZIRB-UHFFFAOYSA-N
ID: 113230
SMILES:C1CC(C)=CC2c3c(cc(CCC)cc3OC(C)=O)OC(C)(C1)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -14.239
InChIKey:QKLSQXLGLDVFOQ-UHFFFAOYSA-N
ID: 113231
SMILES:CC(=C)C1C(c2c(O)cc(O)c(CCC(C)=C)c2)C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.453
CB1 binding score: -15.404
InChIKey:PIPITJAFSIOOHQ-UHFFFAOYSA-N
ID: 113232
SMILES:c12c(O)cc(CCCCC)cc1OC1(C)CCCC2(C)C1C=CC(C)(C)OO
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.548
CB1 binding score: -14.318
InChIKey:ULTAFGBDSNBNPA-UHFFFAOYSA-N