ID: 34693
SMILES:C(C(CCCBr)=CC(=O)c1cc(O)c2c(c1)OC(C)(C)C1CCC(C)=CC21)(O)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 463.368
CB1 binding score: -13.945
InChIKey:SMJUIOYFWMLMOJ-UHFFFAOYSA-N
ID: 34694
SMILES:C(C)(=CC(=O)CC(C)CCOc1cc(CCCCC)cc2c1OC(C)(C)C=C2)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.587
CB1 binding score: -15.913
InChIKey:ZCBCBWXUORQNRI-UHFFFAOYSA-N
ID: 34695
SMILES:O=C(CC)OC1C(C)=C2c3c(cc(CCCCC)cc3OC(C)=O)OC(C)(C)C2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 414.542
CB1 binding score: -16.85
InChIKey:KAJMYXCPJBZWGY-UHFFFAOYSA-N
ID: 34696
SMILES:CC1=Cc2c(O)cc(CCC)cc2OC1(O)C=C(CCC=C(C)C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -15.467
InChIKey:ZCCPXTBAOWIBHA-UHFFFAOYSA-N
ID: 34697
SMILES:C1(C)=CC(O)C2C(C1)c1c(O)cc(CCCCC)c(C(O)=O)c1OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.477
CB1 binding score: -16.527
InChIKey:VELKQVPKGNIHAZ-UHFFFAOYSA-N
ID: 34698
SMILES:CC1(C)C2CC=C(C)CC2c2c(cccc2)O1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 228.335
CB1 binding score: -18.418
InChIKey:UEUDZYHJJLDGIZ-UHFFFAOYSA-N
ID: 34699
SMILES:c1(-c2c(OC)ccc(C)c2)cc2c(cc1O)OC(C)(C)C1CCC(C)=CC12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 364.485
CB1 binding score: -16.438
InChIKey:MUOJRYFKHNQCOQ-UHFFFAOYSA-N
ID: 34700
SMILES:C(c1c(O)c2c(c(C(C(C)C)=O)c1O)OC1(C)C(O)CC=C(C)CCC1C(C)(C)O2)CC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 486.649
CB1 binding score: -10.637
InChIKey:ZBYDPJGTWGDTAU-UHFFFAOYSA-N
ID: 34701
SMILES:C(CCCc1cc2c(c(O)c1)C=CC(C)(C)O2)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 246.35
CB1 binding score: -20.081
InChIKey:XLSYFQOJMWXOCT-UHFFFAOYSA-N
ID: 34702
SMILES:c1(CCCCCCCc2ccccc2)c(O)c2c(c(O)c1C(CC)C)OC(C)(C)C1CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 490.728
CB1 binding score: -15.41
InChIKey:QUGDTAQGLIQJRN-UHFFFAOYSA-N
ID: 34703
SMILES:c12c(c(O)cc(CCCCC)c1)C1CC(C)(O2)C2=CC(=O)C(C)(C)OC2=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.5
CB1 binding score: -15.2
InChIKey:ZDXXGZPRZQFPHF-UHFFFAOYSA-N
ID: 34704
SMILES:OC1(c2c(O)ccc(CCCCC)c2O)CC(C)=CCC1C(C)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -17.02
InChIKey:HTBMWJBBQGFOLS-UHFFFAOYSA-N
ID: 34705
SMILES:C(CC(CO)C)CC(c1cc2c(c(O)c1)C1C(C(C)(C)O2)CCC(C)=C1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.549
CB1 binding score: -14.705
InChIKey:CMUGNHQRWFTLCH-UHFFFAOYSA-N
ID: 34706
SMILES:C1(C(C)=C)C(c2c(O)cc(CCCCC)c(Cl)c2O)CC(C)=CC1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 364.913
CB1 binding score: -15.633
InChIKey:BDZRAQIKZIZASX-UHFFFAOYSA-N
ID: 34707
SMILES:C1(C)=CC(c2c(O)cc(CCCCC)cc2O)C(C(=C)C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.427
InChIKey:QHMBSVQNZZTUGM-UHFFFAOYSA-N
ID: 34708
SMILES:C1(=O)CC2C(C)(C)Oc3c(cc(O)cc3CCC=C(C)C)C2C=C1C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 340.463
CB1 binding score: -13.173
InChIKey:BXRFNXDKPIJTAU-UHFFFAOYSA-N
ID: 34709
SMILES:C1C(C)=CCC2C(C)(C)Oc3c(c(O)cc(CCC)c3)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -19.805
InChIKey:CDBDULHNWQRYSY-UHFFFAOYSA-N
ID: 34710
SMILES:C1CCC(O)=C(C2OC(=O)c3c(CCCCC)cc(OC(=O)C)cc32)C1C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.461
CB1 binding score: -15.293
InChIKey:RUSQKGZWTMVSLQ-UHFFFAOYSA-N
ID: 34711
SMILES:C1(O)C(O)C(O)C(Oc2cc(O)cc(CCCCC)c2)OC1COC(=O)C=C(C)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 424.49
CB1 binding score: -16.306
InChIKey:YBANMKKKMBZFKB-UHFFFAOYSA-N
ID: 34712
SMILES:c12c3c(c(O)c(C(=O)OC(C)(CC)C)[nH]3)c(O)c(C(=O)CC(C)C)c1OC(C)(C)C1CC(=O)C(C)=CC12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 511.615
CB1 binding score: -14.857
InChIKey:SNCAHGRDBDLJCS-UHFFFAOYSA-N
ID: 34713
SMILES:C1=C(C)COc2c1c(O)cc(CCCCC)c2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 232.323
CB1 binding score: -17.881
InChIKey:HZTBOQLZTCDDEK-UHFFFAOYSA-N