ID: 88159
SMILES:C(C=C(CO)C)CC(=CCc1c(O)cc(CCCCC)c(O)c1O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids;Aromatic polyketides
Class: Cannabinoids;Catechols with side chains
MW: 348.483
CB1 binding score: -16.372
InChIKey:UABMFXFGODSREC-UHFFFAOYSA-N
ID: 88160
SMILES:O(C(CCC1(C)Oc2cc(C)c(O)cc2CC1)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 264.365
CB1 binding score: -18.469
InChIKey:YOKZZDKIUOZBNX-UHFFFAOYSA-N
ID: 88161
SMILES:c12c(cc(OC)c(CCCCC)c1)OC(C)(C)C1CCC(O)(C)C21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -13.266
InChIKey:FOBPPNIRRBFYAX-UHFFFAOYSA-N
ID: 88162
SMILES:CCCCCc1cc(O)c2c(c1)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 88163
SMILES:c1(O)c2c(cc(CCCCC)c1)OC(C)(C)c1c-2cc(C)cc1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 310.437
CB1 binding score: -19.554
InChIKey:VBGLYOIFKLUMQG-UHFFFAOYSA-N
ID: 88164
SMILES:c1(OC)c2c(cc(CCCCC)c1)OC(C)(C)C1C2C=C(C(CCC(C)CO)(C)O)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 444.656
CB1 binding score: -15.519
InChIKey:GBEDJGAMMDYOIO-UHFFFAOYSA-N
ID: 88165
SMILES:C1(C)(O)CC(c2c(O)cc(CCC)cc2O)OC1CC(C)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 308.418
CB1 binding score: -14.352
InChIKey:IRCVPHVCBUFJAR-UHFFFAOYSA-N
ID: 88166
SMILES:CC(OC(C(=CC)C)=O)CCc1cc(O)c2c(c1C(=O)C)OC(C)(C)C1CC=C(C=O)C(OC(C)=O)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 512.599
CB1 binding score: -14.268
InChIKey:UHBBHFIPUSQYQZ-UHFFFAOYSA-N
ID: 88167
SMILES:O(c1cc(CCCCC)ccc1)C1CC(C)CCC1C(=C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.486
CB1 binding score: -13.004
InChIKey:WHABNXGKEUXWCN-UHFFFAOYSA-N
ID: 88168
SMILES:C1(O)CC(C(C)C)C(c2c(O)cc(CCCC(C)C)cc2O)C=C1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.511
CB1 binding score: -15.195
InChIKey:NXAJKHFGXLCLHE-UHFFFAOYSA-N
ID: 88169
SMILES:c1(O)c(CC=C(C)C)c(O)c(C(O)=O)c(CCCCC)c1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 292.375
CB1 binding score: -19.394
InChIKey:IQDBYPKRWVDTCI-UHFFFAOYSA-N
ID: 88170
SMILES:C12C=C(C(O)C(C)(C)Oc3cc(CCCCC)cc(O)c31)CC(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -15.876
InChIKey:YUTNGNJHKVBIOC-UHFFFAOYSA-N
ID: 88171
SMILES:C1=CC(C=O)=CC2c3c(cc(CCCCC)cc3O)OC(C)(C)C2CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 394.555
CB1 binding score: -15.014
InChIKey:PYOOFICQOWYWGB-UHFFFAOYSA-N
ID: 88172
SMILES:CC1(C)C(CCC(=O)c2c(O)cc(CCC)cc2O)O1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 278.348
CB1 binding score: -16.056
InChIKey:QFFZEAHPBAVNIF-UHFFFAOYSA-N
ID: 88173
SMILES:C(=O)(OC)c1c(O)c2c(cc1C=CC(CCC=C(C)C)(C)O)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 454.607
CB1 binding score: -14.327
InChIKey:WNNJLHJICKBPPR-UHFFFAOYSA-N
ID: 88174
SMILES:Oc1c(C(C(C)C)=O)c(O)c2c(c1)OC(C)(C)C1CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.424
CB1 binding score: -17
InChIKey:WQYRNJBNQPTOAV-UHFFFAOYSA-N
ID: 88175
SMILES:C1C(C)=CC(c2c(O)cc(O)c(C(CCCCCCC)=O)c2C)C=C(C)CC1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.56
CB1 binding score: -14.501
InChIKey:XWARONHIVIDXJR-UHFFFAOYSA-N
ID: 88176
SMILES:C1(CO)=CCC2C(c3c(O)cc(C)cc3O)OC(C(C)(C)C1)C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.413
CB1 binding score: -14.884
InChIKey:HQNDFGVZTXKTRE-UHFFFAOYSA-N
ID: 88177
SMILES:Oc1c(Cl)c2c(c3c1OC(C)(C)C1C3C=C(C(=O)O)CC1)oc(CCCC)c2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 404.89
CB1 binding score: -14.033
InChIKey:MQHGSZCRFQNDDY-UHFFFAOYSA-N
ID: 88178
SMILES:O=C(C)OCC1=CC2C(C(C)(C)Oc3c2c(O)cc(C)c3)CC1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.396
CB1 binding score: -15.279
InChIKey:RTTQFRAREWGEEB-UHFFFAOYSA-N
ID: 88179
SMILES:Oc1cc(CCCCC)cc2c1C1C(C(C)(C)O2)CC=C(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N