ID: 85282
SMILES:OC1(C)CC2C(O)(C(C)(C)Oc3cc(CCCCC)c(C(OC)=O)c(O)c32)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 406.519
CB1 binding score: -14.648
InChIKey:HUBNZJFBKRDQIY-UHFFFAOYSA-N
ID: 85283
SMILES:CC1(C)Oc2c(c(O)cc(CCc3cc(OC)c(O)cc3)c2)C2C=C(C)CCC12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 394.511
CB1 binding score: -16.127
InChIKey:LXSURDYJHKAVOO-UHFFFAOYSA-N
ID: 85284
SMILES:C1=C(C)CCC(C(=C)C)=C1c1c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.453
CB1 binding score: -20.102
InChIKey:WYXBQMBTZPCTQC-UHFFFAOYSA-N
ID: 85285
SMILES:C(Cc1cc(O)c(C2C(C)(O)C(O)CC2C(O)(C)C)c(O)c1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 324.417
CB1 binding score: -15.614
InChIKey:XMHYJTSSQPUNFK-UHFFFAOYSA-N
ID: 85286
SMILES:CC1(C)Oc2c(c(O)cc(CCCC)c2)-c2c1ccc(C)c2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 296.41
CB1 binding score: -19.327
InChIKey:GGVVJZIANMUEJO-UHFFFAOYSA-N
ID: 85287
SMILES:c1(O)c(O)ccc2c1OC(C)(C)C1C2CC(C)=CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 260.333
CB1 binding score: -16.82
InChIKey:HWSXTNQCABGCDM-UHFFFAOYSA-N
ID: 85288
SMILES:C1CC2C(C(C)C)=CCC2(C)CC2c3c(O)cc(CCCCC)cc3OC(C)(C)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 410.642
CB1 binding score: -13.648
InChIKey:WMOVVIPPNADRMQ-UHFFFAOYSA-N
ID: 85289
SMILES:Oc1c2c(cc(OC3OC(CO)C(O)C(O)C3O)c1O)OC(C)(C)C1C2C=C(C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 438.473
CB1 binding score: -13.937
InChIKey:RJILZLGYUOVXMZ-UHFFFAOYSA-N
ID: 85290
SMILES:C1(c2c(O)cc(CCCCC)cc2O)C(C(CCC=C(C)C)CO)CC(=O)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 390.52
CB1 binding score: -13.836
InChIKey:MRTLWESJXDIIQH-UHFFFAOYSA-N
ID: 85291
SMILES:C12C(C)(CC=C3C(C1C)c1c(O)cc(CCC)cc1O3)C(O)CC(C(O)(C)C)O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 402.531
CB1 binding score: -13.123
InChIKey:ZKAPNUZQAIHRDU-UHFFFAOYSA-N
ID: 85292
SMILES:CCCCCc1ccc(O)c(C2C=C(C)CCC2C(=C)C)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.47
CB1 binding score: -18.247
InChIKey:IJXLDZIYGDHKBA-UHFFFAOYSA-N
ID: 85293
SMILES:C1(C(C)C)C(c2c(O)cc(CCCCC)cc2O)C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.815
InChIKey:PCXRACLQFPRCBB-UHFFFAOYSA-N
ID: 85294
SMILES:C12(CCC(O)CC1)C(C)(C)Oc1cc(O)cc(CCCCC)c1c2=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -14.635
InChIKey:LYZXAHGIGXXDTP-UHFFFAOYSA-N
ID: 85295
SMILES:C(C)CCc1cc(O)cc(CC=C(C)CCC=C(C)C)c1OC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -16.039
InChIKey:HKLWKHBWKKBTJB-UHFFFAOYSA-N
ID: 85296
SMILES:C1=C(C)C(=O)CC=C(C)CCC2C(C)(C)Oc3cc(CCCCC)cc(O)c3C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 396.571
CB1 binding score: -16.396
InChIKey:PFOHOSZXEXPIAM-UHFFFAOYSA-N
ID: 85297
SMILES:O(C(C)=O)C1C2C(C)(C)Oc3c(c(OC)cc(CCCCC)c3)C2C=C(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.532
CB1 binding score: -17.182
InChIKey:GNJCKWWAYUFOHP-UHFFFAOYSA-N
ID: 85298
SMILES:c1(O)c(C(CC2(C)CCC(C)C3(C)C2(C)C=CC2(C)C(C)CC=C4C23O4)=O)c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 506.727
CB1 binding score: -15.562
InChIKey:SHPCOCHBDCVFOQ-UHFFFAOYSA-N
ID: 85299
SMILES:C1Cc2c(cc(C(C)(C)CCCC(=C)CO)cc2C)OC1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.458
CB1 binding score: -13.842
InChIKey:RFOFKVPRHNYTEE-UHFFFAOYSA-N
ID: 85300
SMILES:Cc1c(CCCCC)cc2c(c1O)C=CC(C)(C)O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 260.377
CB1 binding score: -16.019
InChIKey:WERMLHMMWOFHDY-UHFFFAOYSA-N
ID: 85301
SMILES:C1C(C)=CC2c3c(ccc(O)c3C(=O)C(CC)O)C(C)(C)OC2C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.424
CB1 binding score: -13.81
InChIKey:UVVWDEDACZSFTO-UHFFFAOYSA-N
ID: 85302
SMILES:C(CCCc1cc(O)c2c(c1O)OC(CCC=C(C)C)(C)C1C2C=C(C=O)CC1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 412.57
CB1 binding score: -15.848
InChIKey:LSRUUBQZNQAKNA-UHFFFAOYSA-N