ID: 83455
SMILES:Oc1cc2c(c(O)c1)C1C(C(C)(C)O2)CCC(C)(O)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 278.348
CB1 binding score: -16.278
InChIKey:RMUGETNNOLBBSO-UHFFFAOYSA-N
ID: 83456
SMILES:OC1CC(CO)Cc2c(O)cc(CCCCC)cc21
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 264.365
CB1 binding score: -13.308
InChIKey:HDYAAOYRMJDYAZ-UHFFFAOYSA-N
ID: 83457
SMILES:Oc1cc(CCCCC)cc(OC2(C3(C)C4C(C)(CCC3C(C)=CC4)C(C)=CC2=O)O)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 438.608
CB1 binding score: -14.309
InChIKey:SRFRUQDTKITJIZ-UHFFFAOYSA-N
ID: 83458
SMILES:c12cc(CCCCC)cc(O)c1C1C(C(=C)C)CCC2(C)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.47
CB1 binding score: -16.216
InChIKey:WLIYYJXQLNAQDO-UHFFFAOYSA-N
ID: 83459
SMILES:O1c2c(cc(CCCCC)cc2O)C=C(C=O)CCC=C1C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.398
CB1 binding score: -13.718
InChIKey:HEUFUODVYLDETP-UHFFFAOYSA-N
ID: 83460
SMILES:C12(Cc3c(O)cc(CCC)c(C(O)=O)c3O)OC(C)(C)C1CCC(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.45
CB1 binding score: -15.358
InChIKey:WJHKHLATVWTCRC-UHFFFAOYSA-N
ID: 83461
SMILES:CC1C(=C)C(c2c(O)c(O)cc(CCCCC)c2)CC1(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.458
CB1 binding score: -15.421
InChIKey:JXAKYRNQULSLJN-UHFFFAOYSA-N
ID: 83462
SMILES:Oc1cc(CCCCC)cc2c1C1C=C(C)CCC1C(C)(O)CCC2=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.506
CB1 binding score: -15.941
InChIKey:QZXYTKMPIJHVMZ-UHFFFAOYSA-N
ID: 83463
SMILES:c1(CCCC)cc2c(cc1)C1=C(C(C)(C)Oc3cc(CCCCC)cc(O)c32)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 404.594
CB1 binding score: -13.74
InChIKey:MMPXKOCTBTWHEY-UHFFFAOYSA-N
ID: 83464
SMILES:C(CCO)c1cc(O)c2c(c1)OC1(C)CC2C(C)(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 290.403
CB1 binding score: -15.347
InChIKey:JXUDFRKAJQFSNO-UHFFFAOYSA-N
ID: 83465
SMILES:c12c(cc(CCCCC)cc1O)OC(C)(C)C1CC=C(C)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 83466
SMILES:CC1C2C(CC1=S)c1c(O)cc(CCC)cc1OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.455
CB1 binding score: -13.434
InChIKey:NASHJNLXUPFMCF-UHFFFAOYSA-N
ID: 83467
SMILES:C(CCCC)c1cc(O)c2c(c1)OC(C)(C)C1CC=C(C)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 83468
SMILES:C(=CCc1c(O)c(C(=O)O)c(CCCCC)cc1O)(C)CCC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -19.234
InChIKey:SEEZIOZEUUMJME-UHFFFAOYSA-N
ID: 83469
SMILES:Oc1c(O)c2c(c(C(=O)O)c1CCCCC)OC(C)(C)C1CC2C(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.477
CB1 binding score: -16.756
InChIKey:VHCIDFOTFHBHTO-UHFFFAOYSA-N
ID: 83470
SMILES:C(CCC)c1cc(O)c2c(c1)OC(C)(C)C1CC=C(C(O)=O)C1C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.424
CB1 binding score: -15.702
InChIKey:REGBXWXMPQKMBM-UHFFFAOYSA-N
ID: 83471
SMILES:C1CC(C(C)CO)OC2(C)Oc3c4c(cc(CCCCC)c3OC12)OC(C)(C)C1CC=C(C)CC14
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 484.677
CB1 binding score: -15.156
InChIKey:OOHGYILMHSJFDR-UHFFFAOYSA-N
ID: 83472
SMILES:C1(C)(C)Oc2c(cc(CCCCC)cc2O)C2C1CCC(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -19.438
InChIKey:NKPBIUKTNLMNFS-UHFFFAOYSA-N
ID: 83473
SMILES:Oc1cc2c(cc1)OC(CC=CC(C)(C)O)(C)C1CCC(C)=CC12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -16.771
InChIKey:YUEBMUFRDASVCX-UHFFFAOYSA-N
ID: 83474
SMILES:OC(C(C)c1cc2c(cc1OC)OC(C)(C)C1CC=C(C)CC21)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -15.483
InChIKey:ODWDNJVPWXMPGI-UHFFFAOYSA-N
ID: 83475
SMILES:CC1(C)C2CCC(C)=CC2c2c(O)cc(CCCCC)cc21
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.47
CB1 binding score: -19.594
InChIKey:GBBIYEKUPBZPNQ-UHFFFAOYSA-N