ID: 95089
SMILES:C(C)(C)=CCc1c(O)c(C2C=C(C)CC(c3cc(CCCCC)ccc3C=CC(O)=O)c2)cc(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 488.668
CB1 binding score: -12.208
InChIKey:BYZIBJSKGRWLNR-UHFFFAOYSA-N
ID: 95090
SMILES:C1(=O)CC2(C)C3(CCC4(C)Oc5cc(O)cc(CCCCCC)c5)C(C3=C(C(=O)C2)C4)C(C)(C)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 478.673
CB1 binding score: -13.597
InChIKey:LICOXAGVFCHWNZ-UHFFFAOYSA-N
ID: 95091
SMILES:c1(CCCCC)cc(O)c2c(c1)OC(C)(CCC=C(C)C)C=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.933
InChIKey:UVOLYTDXHDXWJU-UHFFFAOYSA-N
ID: 95092
SMILES:C1C(C)=CCC2C(C)(C)Oc3c(c(O)c(OC)cc3)C2C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.387
CB1 binding score: -14.946
InChIKey:GTXWGLPWEPKSPH-UHFFFAOYSA-N
ID: 95093
SMILES:C12(O)C(C)(C(OC(=O)C)CC(C)C13c1c(cc(CCCCC)cc1O)O3)C(O)C(C)C2OC(C)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 490.593
CB1 binding score: -12.626
InChIKey:VENZTRQFWCRZOJ-UHFFFAOYSA-N
ID: 95094
SMILES:C1(Oc2cc(CCCCC)cc(OC)c2O)C(C(C)=C)CCC(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.511
CB1 binding score: -18.667
InChIKey:BBEXLNKSNFPXCL-UHFFFAOYSA-N
ID: 95095
SMILES:Oc1cc(OC)c2c(c1CCCC)OC(C)(CCC=C(C)C)C=C2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -16.138
InChIKey:YFLYGQIVYCQCIM-UHFFFAOYSA-N
ID: 95096
SMILES:C(CC(C)(O)C(=O)c1c(O)cc2c(c1O)C1C=C(C)CCC1C(C)(C)O2)C=C(C)CCC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 482.661
CB1 binding score: -13.433
InChIKey:AIDXMNBDAILDSI-UHFFFAOYSA-N
ID: 95097
SMILES:C(C)(=CCc1c(O)c(CCCCC)c(OC)c2c1OC(C)(C)C(O)C2)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 362.51
CB1 binding score: -14.292
InChIKey:XDZGAWMAKPTIBM-UHFFFAOYSA-N
ID: 95098
SMILES:C12(O)C(=O)c3c(O)cc(CCCCC)cc3OC13C(C=C(C)C3)C1C(C1(C)C)CCC2(O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 454.607
CB1 binding score: -13.802
InChIKey:IUYJNMLCUNWVCR-UHFFFAOYSA-N
ID: 95099
SMILES:C(C=C(C)C)c1c(O)c(C(O)=O)c(CCCCC)cc1O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 292.375
CB1 binding score: -19.394
InChIKey:IQDBYPKRWVDTCI-UHFFFAOYSA-N
ID: 95100
SMILES:C1=C(C)CCC(C(=C)C)C1c1c(O)cc(O)c(C(=O)C(C)CC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -17.445
InChIKey:OQYNYXYZSHEZSE-UHFFFAOYSA-N
ID: 95101
SMILES:c1(O)c2c(cc(CCCCC)c1)OC(C)(C)C1C2CC(CO)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -18.832
InChIKey:LOUSQMWLMDHRIK-UHFFFAOYSA-N
ID: 95102
SMILES:CC(C=C(C)c1c2c(c(O)c(C)c1)OC(C)(C)C1CCC(C)=CC12)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 340.507
CB1 binding score: -13.522
InChIKey:MOVJHTUJZDAYKO-UHFFFAOYSA-N
ID: 95103
SMILES:C(CCc1cc(O)c2c(c1)OC(C)(CO)C1CCC(C)=CC12)CC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.533
CB1 binding score: -16.207
InChIKey:ACAHQKRHUSTHIF-UHFFFAOYSA-N
ID: 95104
SMILES:C1(C)=CC(c2ccc(CCCCC)cc2)C(C(C)(C)O)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.486
CB1 binding score: -18.046
InChIKey:MXECOWWPQRFPTG-UHFFFAOYSA-N
ID: 95105
SMILES:C(CCCC)c1cc2c(c(O)c1)C1C=C(C(=O)O)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -20.052
InChIKey:YOVRGSHRZRJTLZ-UHFFFAOYSA-N
ID: 95106
SMILES:C(C1=CCC2C(c3c(c(O)cc(C)c3O)OC2(C)C)C1)CC=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -14.646
InChIKey:XRGGUDYMTQLPHJ-UHFFFAOYSA-N
ID: 95107
SMILES:C1CC(C(O)=O)CC2c3c(O)c(C(O)=O)c(CCCCC)cc3OC(C)(C)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 390.476
CB1 binding score: -15.76
InChIKey:QMPMXRIRXJVAFN-UHFFFAOYSA-N
ID: 95108
SMILES:c1(O)cc(C)cc2c1C1C(CCC(C)=C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -20.957
InChIKey:WIDIPARNVYRVNW-UHFFFAOYSA-N
ID: 95109
SMILES:C1CC(C)=CCC2C(C)(C)Oc3c(c(OC)cc(CCCCC)c3)C2CC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 396.615
CB1 binding score: -16.046
InChIKey:BNAOTFJFIURVGJ-UHFFFAOYSA-N