ID: 46957
SMILES:C1=C(C)Oc2c(c(O)cc(CCC)c2)C2CC(C)(OC)CCC12
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -12.381
InChIKey:ICKMGKRHLQONCS-UHFFFAOYSA-N
ID: 46958
SMILES:C1c2c(CCCCC)cc(O)cc2OC(C)(C)C1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 248.366
CB1 binding score: -16.655
InChIKey:KGJUMJYDBWHPMU-UHFFFAOYSA-N
ID: 46959
SMILES:C(=CCC(C)=CCc1c(O)c(C(=O)O)c(CCC)cc1O)C(C)(O)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 348.439
CB1 binding score: -16.306
InChIKey:HYLFMVAGOYMSDR-UHFFFAOYSA-N
ID: 46960
SMILES:C(CC)Cc1cc(O)c2c(c1)OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -20.175
InChIKey:RVWTXSLOGRTPEH-UHFFFAOYSA-N
ID: 46961
SMILES:C(Cc1cc(O)c(C2C(C(C)=C)CCC(C)=C2)cc1)CN(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 313.485
CB1 binding score: -16.756
InChIKey:UWTYEGCXJILBGD-UHFFFAOYSA-N
ID: 46962
SMILES:C1C2(C=O)c3c(cc(CCCCC)cc3O)OC(C)C2C1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.387
CB1 binding score: -16.029
InChIKey:HXNSBNJKPNMFAY-UHFFFAOYSA-N
ID: 46963
SMILES:C(CCC)CCc1cc(O)cc(C2C(=O)C(C)(C)CC=C2C)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -16.61
InChIKey:XQVFYVSBOMUTQD-UHFFFAOYSA-N
ID: 46964
SMILES:C(=C(C)CC)Cc1c(O)cc(CCCC)cc1O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 248.366
CB1 binding score: -13.284
InChIKey:QZQBPWBLRJLCKF-UHFFFAOYSA-N
ID: 46965
SMILES:c1(C(=O)C=C(C)C)c(C(=O)OC)c(O)c2c(c1)OC(C)(C)C1CC=C(C)CC21
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.472
CB1 binding score: -15.743
InChIKey:BCDNOOPPOKVGNE-UHFFFAOYSA-N
ID: 46966
SMILES:C1CC2(C)OCC2(C)C2C1c1c(O)cc(CCCCC)cc1OC2C=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -14.856
InChIKey:YDGFFRRORZURQD-UHFFFAOYSA-N
ID: 46967
SMILES:C(Cc1cc(O)c(C(OC)=O)c2c1OC(C)(C)C1CC=C(C(=O)O)CC21)CCCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 430.541
CB1 binding score: -16.715
InChIKey:GFANWFKOANKUIO-UHFFFAOYSA-N
ID: 46968
SMILES:CC12C(Cc3c(c(O)c(C(=O)O)c(CCCCC)c3)O1)C1CC(C(C)C)(CC2)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 402.531
CB1 binding score: -16.608
InChIKey:KBWAKFYNGOGSET-UHFFFAOYSA-N
ID: 46969
SMILES:O(C)c1c(C)c(O)c2c(c1O)C=CC(C)(CC=CC(C)(C)OC)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 334.412
CB1 binding score: -13.221
InChIKey:AXNOAANEHKRHTM-UHFFFAOYSA-N
ID: 46970
SMILES:Oc1c(O)c(C)cc2c1C1C(CC(O)C(C)(C)O1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Miscellaneous meroterpenoids
MW: 308.374
CB1 binding score: -13.679
InChIKey:DDKUYIDJSHAUDE-UHFFFAOYSA-N
ID: 46971
SMILES:C(C1(C)C2C(C)(C=CC1)C(c1c(O)cc(CCCCC)cc1O)=C(C)CC2)(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 396.615
CB1 binding score: -16.206
InChIKey:OJGALNGPUKLOFP-UHFFFAOYSA-N
ID: 46972
SMILES:C(CCC)Cc1cc(O)c(C2C=C(C)CCC2C(C)=C)cc1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.47
CB1 binding score: -18.957
InChIKey:OANGEIYPAQYPQV-UHFFFAOYSA-N
ID: 46973
SMILES:Oc1c(OC)c(C)cc2c1C1C(C(C)(C)O2)CCC(CO)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.386
CB1 binding score: -15.324
InChIKey:ACOXOGKCUDEEEF-UHFFFAOYSA-N
ID: 46974
SMILES:C12=C(c3c(O)cc(CCCCC)cc3OC(C)(C)C1=O)OCC1C2(C)CCCC1(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 426.597
CB1 binding score: -11.37
InChIKey:YYTBULOOTRGTPJ-UHFFFAOYSA-N
ID: 46975
SMILES:C1C(O)C(C(O)=O)=CC2C1C(C)(C)Oc1c2c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.45
CB1 binding score: -17.183
InChIKey:AREGKQBLOXHIRP-UHFFFAOYSA-N
ID: 46976
SMILES:C12(C)Oc3c(c(O)cc(CCCCC)c3)C3C1C(CCC2C)C(C)C(C)C3
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.577
CB1 binding score: -16.048
InChIKey:XCBFEKGEGJGGCI-UHFFFAOYSA-N
ID: 46977
SMILES:CC1(C(O)=O)C2CC=C(C)CC2c2c(cc(CCCCC)cc2O)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -16.137
InChIKey:GAUNMBMXRFOTAX-UHFFFAOYSA-N