ID: 36037
SMILES:Oc1c(C(C(CC)C)=O)c2c(c(O)c1)C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -18.453
InChIKey:NIZQVFOBIVYVBJ-UHFFFAOYSA-N
ID: 36038
SMILES:C1CC(C(CCC=C(C)C)(C)O)Oc2c(c(O)cc(CCCCC)c2)C1=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.521
CB1 binding score: -15.889
InChIKey:NIYKMGFYVKETHK-UHFFFAOYSA-N
ID: 36039
SMILES:C(CCC(O)C(O)(C)CCC=C(C)C)(=CCc1c(O)cc(CCc2ccc(O)cc2)cc1O)C(=C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 494.672
CB1 binding score: -15.961
InChIKey:IHUNAUFTERNZNU-UHFFFAOYSA-N
ID: 36040
SMILES:C1(C(C)C)C(c2c(O)cc(CCCCC)cc2O)C(O)C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 334.5
CB1 binding score: -18.58
InChIKey:QSWUPWBGGAGFKI-UHFFFAOYSA-N
ID: 36041
SMILES:C(c1cc2c(c(O)c1)C1C(C(C)(C)O2)CCC(C)=C1)CC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -19.321
InChIKey:ZROLHBHDLIHEMS-UHFFFAOYSA-N
ID: 36042
SMILES:Brc1c(O)cc2c(c1)C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 323.23
CB1 binding score: -18.662
InChIKey:OLWQGBDFFXCSTJ-UHFFFAOYSA-N
ID: 36043
SMILES:CC1(C)Oc2c(c(O)cc(CCCCC)c2)C2C1CC(=O)C(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -19.026
InChIKey:FJVJQPVMJALOMF-UHFFFAOYSA-N
ID: 36044
SMILES:c1(CCCC(C(O)=O)CC(OCC(C)C)=O)cc(O)c(C2C=C(C)CCC2C(=C)C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 458.595
CB1 binding score: -14.02
InChIKey:XMGLFCRERHQKAD-UHFFFAOYSA-N
ID: 36045
SMILES:O=C1CC(C)(C)Oc2c3c(c4c(c21)OC(C)C4)OC(C)(C)C1C3C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.5
CB1 binding score: -12.437
InChIKey:KQBMXRHPGKELJB-UHFFFAOYSA-N
ID: 36046
SMILES:c1c(C)c2c(c(C)c1)C(=O)c1c(O)cc(CCCCC)cc1OC(C)(CCC=C(C)C)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 434.62
CB1 binding score: -16.246
InChIKey:ZMGWGASVGBEAOM-UHFFFAOYSA-N
ID: 36047
SMILES:C1C=CC(C)(C)Oc2cc(CCCCC)c(C(=O)O)cc21
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.387
CB1 binding score: -14.698
InChIKey:NIRQGLMRVSAUKE-UHFFFAOYSA-N
ID: 36048
SMILES:C12(C)C(C)CCCC13C(C)(Oc1c3c(O)cc(CCCC)c1)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -13.481
InChIKey:IOPDNGMLMJZUIH-UHFFFAOYSA-N
ID: 36049
SMILES:C(=C(C)C)CC1C(C)(C)Oc2ccc(O)c(c2C(=O)CCCCC)C(O)C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 428.613
CB1 binding score: -14.084
InChIKey:YFSWXMNQFFUSGW-UHFFFAOYSA-N
ID: 36050
SMILES:C(C)(=CCCC(O)(C)C1C(c2c(OC(=O)C)cc(CCCCC)cc2O)OC(C)(C)C=C1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 458.639
CB1 binding score: -15.369
InChIKey:LPJSPJGSFCVPCW-UHFFFAOYSA-N
ID: 36051
SMILES:Oc1c2c(c(OC)cc1C)C(C)OC(C)(CO)CCCC(C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 338.444
CB1 binding score: -14.811
InChIKey:DEKRBGZOBRUOOM-UHFFFAOYSA-N
ID: 36052
SMILES:C1CC2c3c(cc(CCCCC)cc3O)OC(C)(C)C2CC1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -17.571
InChIKey:YXYUFQADKYZXBS-UHFFFAOYSA-N
ID: 36053
SMILES:C1(=O)c2c(C(C(=CC)C)=O)c(O)c(C=O)c(O)c2C2C=C(C)CCC2C(C)(C)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.455
CB1 binding score: -14.902
InChIKey:CSORRNJAOKPYPU-UHFFFAOYSA-N
ID: 36054
SMILES:C(C)CCCc1cc(O)c2c3c1C1C(C(C)(C)O2)CC3C(C)(O)CCC1C(C)(O)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 416.602
CB1 binding score: Not available
InChIKey:ILHCICTZGCCYMZ-UHFFFAOYSA-N
ID: 36055
SMILES:C12C(c3c(O)cc(C(O)CCC)cc3O1)CC(C(=C)C)C2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.387
CB1 binding score: -16.721
InChIKey:RFWVRMYZNIPBPP-UHFFFAOYSA-N
ID: 36056
SMILES:C1C(C)=CCCC2(C)C(O2)c2c(O)cc(CCCCC)cc21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -12.4
InChIKey:CFHCJXJAOZCQQI-UHFFFAOYSA-N
ID: 36057
SMILES:C1C2(c3c(cc(CCCCC)cc3O)OC1=O)CC(CCC)C(C)C2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -16.667
InChIKey:CJGPOZVSTVXUIR-UHFFFAOYSA-N