ID: 91792
SMILES:C(=O)C1=CC2C(C(C)(C)Oc3cc(CCC)cc(O)c32)CC1CC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 368.517
CB1 binding score: -15.008
InChIKey:PGKYVNKVZAKJJM-UHFFFAOYSA-N
ID: 91793
SMILES:c1c(CCCCC)cc2c(c1O)C1C(C(C)(C)O2)OC(C(OC)=O)(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 376.493
CB1 binding score: -15.197
InChIKey:IKFZCTOFUNHHFM-UHFFFAOYSA-N
ID: 91794
SMILES:C1(O)C(O)C(O)C(CO)OC1OCC1=CC2c3c(cc(CCCCC)cc3OC)OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 506.636
CB1 binding score: -15.662
InChIKey:SSOGBMFIEGCWNW-UHFFFAOYSA-N
ID: 91795
SMILES:C12(C)C(=C)CCC(C(C)C)C1c1c(cc(CCCCC)cc1O)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -15.668
InChIKey:AZTSDPJFBFIAMO-UHFFFAOYSA-N
ID: 91796
SMILES:C(CC(=O)C)C1C(C)(C)Oc2c1c(O)cc(CCCCC)c2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.43
CB1 binding score: -18.167
InChIKey:QSOGTOVBOHNCQA-UHFFFAOYSA-N
ID: 91797
SMILES:C12(C)C(C)(C)C(C(=O)O)(Cc3c(cc(C)c(O)c3)Oc3cc(CCCCC)cc(O)c31)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 452.591
CB1 binding score: -14.308
InChIKey:KPHNVNOGBIJDFU-UHFFFAOYSA-N
ID: 91798
SMILES:c12c(OC)cc(CCCCC)cc1OC(C)(C)C1CC=C(CO)C=C21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -16.926
InChIKey:YIYGATZIFZQIEG-UHFFFAOYSA-N
ID: 91799
SMILES:C(CCC)Cc1cc2c(c(O)c1)C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 91800
SMILES:C12C=C(COC3C(O)C(O)C(O)C(CO)O3)CCC1C(C)(C)Oc1c2ccc(O)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 422.474
CB1 binding score: -14.896
InChIKey:FZZDYADCOJTUPS-UHFFFAOYSA-N
ID: 91801
SMILES:C(C)CCCc1cc2c(c(O)c1C(O)=O)C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -19.351
InChIKey:UCONUSSAWGCZMV-UHFFFAOYSA-N
ID: 91802
SMILES:C(CCCc1cc2c(c(O)c1)C1C(C(C)(C)O2)CC=C(C)C1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 91803
SMILES:c12c(OC)cc(CCCCC)cc1OC(C)(C)C1C2C=C(C(O)=O)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -17.195
InChIKey:VPBHUGWJPCPNEC-UHFFFAOYSA-N
ID: 91804
SMILES:C(CCC)Cc1cc(O)c2c(c1)C1CC(C)=CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -18.779
InChIKey:ZSDJPGLYWNHCIW-UHFFFAOYSA-N
ID: 91805
SMILES:O1c2c(c(C)c(CCCC(C)C)cc2)CCC1(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 260.421
CB1 binding score: -14.593
InChIKey:QYPKQXDNHWYHMX-UHFFFAOYSA-N
ID: 91806
SMILES:Oc1c2c(cc(CCCCC)c1O)C1C(C(C)(C)O2)CC=C(C)C1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -16.522
InChIKey:ZKXQEUPZLQCNML-UHFFFAOYSA-N
ID: 91807
SMILES:C(CCC)Cc1cc2c(c(O)c1)C1C(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
ID: 91808
SMILES:C1=C(C)CCC(COC)(C)C2CCC(C)=CC2c2c1c(C(=O)O)c(CCCCC)c(Cl)c2O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 475.069
CB1 binding score: -14.817
InChIKey:AGDOSZYGNABJDE-UHFFFAOYSA-N
ID: 91809
SMILES:C1C(C)=CCC2C(C)(C)Oc3c(c(O)cc(C)c3)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -18.619
InChIKey:MMZAEMNNHWYQKW-UHFFFAOYSA-N
ID: 91810
SMILES:c12c(cc(C)cc1O)OC(CCc1c(O)c(C(O)=O)c(C)cc1O)(C)CCC=C(C)C2C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 440.536
CB1 binding score: -13.633
InChIKey:GPKYAXKDWXKUPJ-UHFFFAOYSA-N
ID: 91811
SMILES:C1(C)=CC2C(C(C)(C)Oc3c2c(O)c(CC=C(C)CCC=C(C)C)c(C(C(C)C)=O)c3O)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 466.662
CB1 binding score: -15.677
InChIKey:KEULUAZANRCRCD-UHFFFAOYSA-N
ID: 91812
SMILES:C1=C(C)CCC2C(C)(C)Oc3cc(CCc4ccccc4)cc(O)c3C2C1O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 378.512
CB1 binding score: -13.824
InChIKey:PSENPARJONJHBN-UHFFFAOYSA-N