ID: 99835
SMILES:c1(O)c2c(cc(CCCCC)c1)OC(C)(C)c1c-2cc(CCCCC)cc1O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.544
CB1 binding score: -16.917
InChIKey:MISCTVSNNMRHNK-UHFFFAOYSA-N
ID: 99836
SMILES:C12C(C)CCC(=C1)C(C)(C)Oc1c2c(O)cc(CC)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.388
CB1 binding score: -17.135
InChIKey:SPTLNYAZXCZEEU-UHFFFAOYSA-N
ID: 99837
SMILES:C(CCC)Cc1c(O)c(C2C=C(C)CCC2C(=C)C)c(O)cc1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -17.615
InChIKey:CRXGOYTUACLVFE-UHFFFAOYSA-N
ID: 99838
SMILES:C1C=C(C)CC2C(C(C)(C)Oc3c(C(=O)CC(C)C)c(OC)cc(OC)c32)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.532
CB1 binding score: Not available
InChIKey:VVEBRBNJTBJBRU-UHFFFAOYSA-N
ID: 99839
SMILES:C(CC=C(C)C)C(C)=CCc1c(O)cc(CCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.431
CB1 binding score: -19.824
InChIKey:YJYIDZLGVYOPGU-UHFFFAOYSA-N
ID: 99840
SMILES:c1c(CCCCC)c(O)cc2c1C1(O)C(C(C)(C)O2)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -15.723
InChIKey:HQATWJCMNOXPOD-UHFFFAOYSA-N
ID: 99841
SMILES:C1C(Cl)C(C)(C)Oc2c1c(O)cc(CCCCC)c2O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.81
CB1 binding score: -14.467
InChIKey:DSEOYUXHEASVSK-UHFFFAOYSA-N
ID: 99842
SMILES:c1(C2C=C(C)CCC2C(=C)C)ccc(C)cc1OC(C)=O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 284.399
CB1 binding score: -17.733
InChIKey:HDJDTLOFFFUHFT-UHFFFAOYSA-N
ID: 99843
SMILES:C1C2C(C)(COc3cc(CCCCC)cc(O)c3)C(C)=CC(=O)C2C(C)(C)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.56
CB1 binding score: -13.954
InChIKey:YMCKGQCJNRZFLU-UHFFFAOYSA-N
ID: 99844
SMILES:C1(C(C)C)C(c2c(O)cc(CCCCC)cc2O)CC(CO)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -17.052
InChIKey:MMEWFWWQGITDLK-UHFFFAOYSA-N
ID: 99845
SMILES:C1CC(C)=CC2c3c(cc(CCCCC)c(C(=O)O)c3O)OC(C)(C)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -19.351
InChIKey:UCONUSSAWGCZMV-UHFFFAOYSA-N
ID: 99846
SMILES:C(C)(=CCCC(C)=CCc1c(O)c(C(OC)=O)c(CCCCC)cc1O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 374.521
CB1 binding score: -19.567
InChIKey:RSOBBJCWWQRAAM-UHFFFAOYSA-N
ID: 99847
SMILES:C(c1cc(O)c2c(c1)CC(O)C(C)(CCC=C(C)C)O2)CC
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.43
CB1 binding score: -16.42
InChIKey:QOCXFHXFLAQMBN-UHFFFAOYSA-N
ID: 99848
SMILES:Oc1c(C(O)=O)ccc2c1C(C=C(C)C)CC1(Oc3c(c(O)cc(CCC)c3)C1)C=C2C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 434.532
CB1 binding score: -15.058
InChIKey:YZIJSLBAFWTKJE-UHFFFAOYSA-N
ID: 99849
SMILES:O(C1C(C)(C)Oc2cc(CCCCC)cc(O)c2C1O)C(C)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 320.429
CB1 binding score: -15.2
InChIKey:CSLJGILVYKNGIK-UHFFFAOYSA-N
ID: 99850
SMILES:OC1C(C)=CCC2C1C(C)(C)Oc1cc(CCCC)ccc12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -14.259
InChIKey:GKQJEHSCAVEPCP-UHFFFAOYSA-N
ID: 99851
SMILES:C1C(C)=CCC(C(=C)C)C1c1c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.129
InChIKey:ZTGXAWYVTLUPDT-UHFFFAOYSA-N
ID: 99852
SMILES:C1(=O)CC2C(CCC3C2(C)CC=CC3(CO)C)(C)Oc2c(c(O)cc(CCC)c2)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 412.57
CB1 binding score: -15.234
InChIKey:BGCBQJNYFXEUEA-UHFFFAOYSA-N
ID: 99853
SMILES:C(Cc1c(O)cc(CCCCC)cc1O)(C=CC=C(C)C)(CCC=C(C)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.604
CB1 binding score: -14.578
InChIKey:HQUXOXCLACVIFN-UHFFFAOYSA-N
ID: 99854
SMILES:C(CC)Cc1cc2c(cc1)OC(C)(C)C1C2=CC2(C(C)(N=C=S)CCC2C(C)CCC=C(C(=O)O)C)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 521.767
CB1 binding score: Not available
InChIKey:CXEAXHFQKRKIHA-UHFFFAOYSA-N
ID: 99855
SMILES:C12(C3C(CO)(C(C)CCC1)C3)c1c(OC)cc(CCCCC)cc1O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -14.664
InChIKey:OTNFFIGEUMOVBB-UHFFFAOYSA-N