ID: 87886
SMILES:c12c(c(C(C=C)(C)C)c(O)cc1O)OC(C)(C)C1C2CC(C)=CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -17.646
InChIKey:HUIFNBBRMZWIRG-UHFFFAOYSA-N
ID: 87887
SMILES:c12c(cc(CCCCC)cc1O)OC1(CBr)C(CC2)C(C)(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 395.381
CB1 binding score: -14.308
InChIKey:QERBBDDZTSSGDL-UHFFFAOYSA-N
ID: 87888
SMILES:C12C(C)=CC(=O)C1(O)C(=C)COc1c2c(OC)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.435
CB1 binding score: -14.974
InChIKey:FGTUKNNTGSEOPW-UHFFFAOYSA-N
ID: 87889
SMILES:C(c1cc2c(c(O)c1)C1C(C(C)(C)O2)CCC(C)C1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.404
CB1 binding score: -18.253
InChIKey:YQZKSASIODXUPT-UHFFFAOYSA-N
ID: 87890
SMILES:O(c1cc(CCCCCC)c2c(c1)OC(C)(C)C1CC=C(C)CC21)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.523
CB1 binding score: -16.869
InChIKey:UJTLWIAYKMGFLT-UHFFFAOYSA-N
ID: 87891
SMILES:C1(C)(O)Oc2c(c(CCCCC)cc(O)c2C)CC1C(O)(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 322.445
CB1 binding score: -15.625
InChIKey:SPDXUGKWOCJYBM-UHFFFAOYSA-N
ID: 87892
SMILES:C1(C)=CC2C(C(C)(C)Oc3c(OC)cc(C(OC)=O)c(O)c32)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.396
CB1 binding score: -15.201
InChIKey:LOQIKTVYCIVXQC-UHFFFAOYSA-N
ID: 87893
SMILES:c1(Cl)c(CCCCC)cc(OC)cc1OCC1C(CCC=C(C)C)(C)C2CC(=O)C(C)=C(C)C2(C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 529.205
CB1 binding score: -16.799
InChIKey:ZSYINXCOGOUKTA-UHFFFAOYSA-N
ID: 87894
SMILES:CCCCCCCc1cc(O)c(C2C=C(C)CCC2C(=C)C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.523
CB1 binding score: -18.188
InChIKey:GGHRHCGOMWNLCE-UHFFFAOYSA-N
ID: 87895
SMILES:C1(C(C)=C)C(c2c(O)cc(C)cc2O)C=C(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 244.334
CB1 binding score: -17.746
InChIKey:FTDDGRKOGLVQPF-UHFFFAOYSA-N
ID: 87896
SMILES:c1(O)c2c(cc(CCCCC)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: 87897
SMILES:Oc1cc(CCCCC)cc(O)c1C1OC(C)(C)C2CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -16.094
InChIKey:ZITAZFDAJLZEPQ-UHFFFAOYSA-N
ID: 87898
SMILES:O1c2c(c(O)cc(CCCCCC)c2)C2C1(C)CCC(C)(O)C2=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -12.44
InChIKey:ULUJLFRFLYMNDJ-UHFFFAOYSA-N
ID: 87899
SMILES:c12cc(CCC(C)(O)C)c(C(=O)O)cc1OC(C)(C)C(Cl)CC2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 340.847
CB1 binding score: -16.093
InChIKey:HKNKNZHAXSXESI-UHFFFAOYSA-N
ID: 87900
SMILES:C1CC(C(C)C)C(c2c(O)cc(CCC)cc2O)CC1C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 290.447
CB1 binding score: -19.319
InChIKey:VNFNICPIQJPBJY-UHFFFAOYSA-N
ID: 87901
SMILES:C12C(C(=O)CC1C)c1c(O)cc(CCCC)cc1OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.414
CB1 binding score: -16.438
InChIKey:DGVZIUIGIGZOBD-UHFFFAOYSA-N
ID: 87902
SMILES:Cc1c2c(c(C)c(O)c1)CC1(O)C(C(C)(C)Oc3c(O)c(C)cc(O)c31)C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.445
CB1 binding score: -16.665
InChIKey:SMEJRSJQITWUJX-UHFFFAOYSA-N
ID: 87903
SMILES:c1(CCCCC)ccc2c(c1C)OC(C)(C)C1CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.497
CB1 binding score: -16.224
InChIKey:ABTPSNXQKSFZOD-UHFFFAOYSA-N
ID: 87904
SMILES:c12c(c(O)cc(CCCCC)c1)C1C=C(C=O)CC(OC)C1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -13.673
InChIKey:BHJSYTJSINTXHE-UHFFFAOYSA-N
ID: 87905
SMILES:CC1=CC(c2c(OC)ccc(CCN(C)C)c2)C(C(C)=C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 313.485
CB1 binding score: -18.294
InChIKey:GJDVDGGMUGCJGX-UHFFFAOYSA-N
ID: 87906
SMILES:C1C(OC(C(C(=O)C(C(C)C)C)C)c2cc(O)c(CC=C(C)CCC=C(C)C)c(O)c2)CCC(O)=N1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 499.692
CB1 binding score: -15.19
InChIKey:GWIRCSGGSNLIAM-UHFFFAOYSA-N