ID: 13231
SMILES:c1(O)cc(CCCCC)cc2c1C1C(C(C)(C)O2)CC=C(C)C1CC=C(C)CCC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 450.707
CB1 binding score: -15.929
InChIKey:BTZORMYGEYEXGR-UHFFFAOYSA-N
ID: 13232
SMILES:C12C3C(N=C=S)(C)CCC4C(C3(C)C1c1c(cc(CCCCC)cc1O)O4)OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 441.637
CB1 binding score: -12.152
InChIKey:RMNKGYDLMMRSIS-UHFFFAOYSA-N
ID: 13233
SMILES:C(C)(=CCCC(=CCc1c(O)c(CC=C(C)C)cc(O)c1)C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -18.748
InChIKey:VRXKPPYOGGSRFK-UHFFFAOYSA-N
ID: 13234
SMILES:C(CC=CC=CCc1cc2c(cc1)OC(C)(C)C1C2C=C(C)CC1)CCC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 404.638
CB1 binding score: -14.152
InChIKey:BCBIUKDCRIJMOD-UHFFFAOYSA-N
ID: 13235
SMILES:C12(COc3cc(CCCCC)cc(O)c3)C(C(C)(C)CCC1O)CCC(C=O)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.559
CB1 binding score: -14.473
InChIKey:WKZWSMGTTMWCHY-UHFFFAOYSA-N
ID: 13236
SMILES:c1(O)c2c(c(S(=O)(O)=O)c(O)c1)-c1c(cc(CCCCC)cc1O)OC(C)(C)C2O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 438.498
CB1 binding score: -12.321
InChIKey:YYTPJOHTMDLWPW-UHFFFAOYSA-N
ID: 13237
SMILES:C12C(C)(Oc3c(c(OC)cc(CCCCCC)c3)C1O)CCC1C2(C)CCCC1(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 428.657
CB1 binding score: -15.548
InChIKey:BYWGBBWNIRHZFL-UHFFFAOYSA-N
ID: 13238
SMILES:CC1=C(CCC(=C)C)C(C)c2c(cc(CS)cc2O)O1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 290.428
CB1 binding score: -12.034
InChIKey:BJZZPXYWFLEMAW-UHFFFAOYSA-N
ID: 13239
SMILES:C(CCC)Cc1cc2c(c(O)c1)OC(C)(CCC=C(C)C)C=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -19.028
InChIKey:BNDLCGBREIIGHD-UHFFFAOYSA-N
ID: 13240
SMILES:COc1c(O)c2c(cc1C)C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.387
CB1 binding score: -17.049
InChIKey:ANBHAOJZFCATKM-UHFFFAOYSA-N
ID: 13241
SMILES:O1c2c(c(O)cc(CCCCC)c2)C2C3(CO)C(C(C)(C)CCC3)CCC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.549
CB1 binding score: -15.152
InChIKey:PRNCBKXHHVBHOV-UHFFFAOYSA-N
ID: 13242
SMILES:O1c2c(c(O)cc(CCC)c2)C2CC(C)=CCC3C(C)(C)C3C2=C(C)C1=O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 366.501
CB1 binding score: -15.63
InChIKey:ZFHAIDZNOMHNFQ-UHFFFAOYSA-N
ID: 13243
SMILES:c12c(cc(CCCCC)cc1)OC(C)(C)C1CC=C(C)CC21O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -16.325
InChIKey:RADCGLIZSIAKLR-UHFFFAOYSA-N
ID: 13244
SMILES:C1=C(C)CCC(C(C)=C)C1c1c(O)c2c(c(C(=O)CCC)c1O)OC(C)(C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.543
CB1 binding score: -16.965
InChIKey:QAIOGBFXYRFJNL-UHFFFAOYSA-N
ID: 13245
SMILES:O1C(C)CCC(C(C)=C)C2c3c(O)cc(C)cc3OC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.36
CB1 binding score: -15.681
InChIKey:CZMXPGVVPZHLIG-UHFFFAOYSA-N
ID: 13246
SMILES:C(CCC)Cc1cc(O)c(C2C(C(COC(=O)C)=C)CCC(C)=C2)cc1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.506
CB1 binding score: -13.706
InChIKey:HKNLMOOSTKDNPX-UHFFFAOYSA-N
ID: 13247
SMILES:C(CCc1cc2c(c(O)c1)C1C=C(C)CCC1C(C)(C)O2)CC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 13248
SMILES:C(O)C1(CCC=C(C)C)Oc2c(c(O)cc(CCCCC)c2)C=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -17.921
InChIKey:LPZVTZIHYKJYHT-UHFFFAOYSA-N
ID: 13249
SMILES:CC(C=CC(C1(C)C2CCC(CO)=CC2c2c(cccc2)O1)N)=C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 325.452
CB1 binding score: -17.036
InChIKey:GLOJGTREXPNKIN-UHFFFAOYSA-N
ID: 13250
SMILES:c1(CCCCC)cc(O)c(C2C(C(C)=C)CCC(C)=C2)c(O)c1C=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -17.8
InChIKey:RAYRUJHFLUVASM-UHFFFAOYSA-N
ID: 13251
SMILES:c12c(cc(CCCCC)cc1CC(C)=O)OC(C)(C)C1CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 354.534
CB1 binding score: -15.641
InChIKey:YCRJNASHAJNRSK-UHFFFAOYSA-N