ID: 10228
SMILES:C12(C)OC1(c1c(OC)cc(CCCCC)cc1O)OC(C)(C)C1C2C(O)C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 418.574
CB1 binding score: -15.429
InChIKey:HVNVEDSQZQUGSZ-UHFFFAOYSA-N
ID: 10229
SMILES:C1CC(C=C)(C)C(c2c(O)cc(CCC)cc2O)CC1(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.458
CB1 binding score: -16.74
InChIKey:WXKJDTAZGULYRM-UHFFFAOYSA-N
ID: 10230
SMILES:C1(C)=CCC(C(C)=C)CC1OC(c1c(O)cc(CCCCC)c(C(=O)O)c1O)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 402.487
CB1 binding score: -14.524
InChIKey:FCQXVXPCVVSXEW-UHFFFAOYSA-N
ID: 10231
SMILES:C(CCCc1cc(OC)c2c(c1)OC(C)(C)CC2C=C(C)C)c1c(O)cc(O)c2c(OC)cc(O)cc12
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 506.639
CB1 binding score: -15.91
InChIKey:KLNNILVFYBHRCZ-UHFFFAOYSA-N
ID: 10232
SMILES:Oc1c(C(CC(C)C)=O)c2c(c(O)c1)C1C(CC=C(C)C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -17.831
InChIKey:YHIVFUIEZCDTGJ-UHFFFAOYSA-N
ID: 10233
SMILES:CC(CCc1c(CC(NCCc2ccc(O)cc2)=O)cc2c(c1)C1C(C(C)(C)O2)CCC(C=O)C1)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 491.672
CB1 binding score: -15.289
InChIKey:LRPQKIFTJHOGLC-UHFFFAOYSA-N
ID: 10234
SMILES:c1(O)cc(CCCC)cc2c1C1(O)C(C(C)(C)O2)CCC(O)(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 334.456
CB1 binding score: -16.015
InChIKey:FFBLPKFHAOUSBT-UHFFFAOYSA-N
ID: 10235
SMILES:Oc1cc(CCCCC)cc2c1C1C(C(C)(C)O2)CC2=C(C)CCC2C(C)(C)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.587
CB1 binding score: -14.287
InChIKey:FTTVOTLJULBULJ-UHFFFAOYSA-N
ID: 10236
SMILES:C1(=O)C(CCC=C(C)C)(C)Oc2c(c(O)cc(CCCCC)c2)C=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -16.356
InChIKey:BLUBFZXFWOMHNI-UHFFFAOYSA-N
ID: 10237
SMILES:C1(C)(C)CCCC2(C)C3C(=CCC12)c1c(O)cc(CCCCC)cc1OC3=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.544
CB1 binding score: -14.697
InChIKey:UZWRVWCSAQHMJH-UHFFFAOYSA-N
ID: 10238
SMILES:C(C(C)=CCc1cc(O)c(CCC(O)(C)C)cc1O)CC=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -15.783
InChIKey:HTIUKLZVDVDHED-UHFFFAOYSA-N
ID: 10239
SMILES:CCCCCc1cc2c(c(O)c1)C1C(O1)C(C)(C)O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 262.349
CB1 binding score: -19.296
InChIKey:GEMPDHCIWOATES-UHFFFAOYSA-N
ID: 10240
SMILES:C=C(C)C1C=CC(c2c(O)cc(CCCCC)cc2OC)(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: Not available
InChIKey:XRSHSXLSSDPQAH-UHFFFAOYSA-N
ID: 10241
SMILES:C(CCC)Cc1cc(O)c(C2C=C(C)CCC2C(C)C)cc1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.486
CB1 binding score: -18.957
InChIKey:XFYKOYWZVVGAEV-UHFFFAOYSA-N
ID: 10242
SMILES:c1(O)c2c(cc(CCCCC)c1)OC(C)(C)C1CC=C(C)C1C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -19.723
InChIKey:WKFVIMFNRJVSJG-UHFFFAOYSA-N
ID: 10243
SMILES:C1(=O)CC(C(C)C)C(c2cccc(Cl)c2)Oc2c1c(O)cc(CCCCC)c2
Pathway: Polyketides;Shikimates and Phenylpropanoids
Superclass: Meroterpenoids;Flavonoids
Class: Cannabinoids;Flavanones
MW: 400.946
CB1 binding score: -13.688
InChIKey:CVHOZRWJMDDRAD-UHFFFAOYSA-N
ID: 10244
SMILES:C(C)(CCC=C(C)C)=CCc1c(O)cc(CCCCCCCCOC(=O)C)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 416.602
CB1 binding score: -16.592
InChIKey:HHAALRVGCYTOCL-UHFFFAOYSA-N
ID: 10245
SMILES:CC1(C)Oc2c(c(O)cc(CCCCC)c2O)C2(C)C1CC=C(C)C1C2C=C(C)C(=O)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 438.608
CB1 binding score: -12.301
InChIKey:QNWKHORDICYLCT-UHFFFAOYSA-N
ID: 10246
SMILES:C(C)(C1(O)CCC2C(C)(C1)Oc1cc3c(c(O)c1C=C2C)C(CCCC(C)C)(C)O3)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 428.613
CB1 binding score: -13.959
InChIKey:WXKQXKWKMQDLHH-UHFFFAOYSA-N
ID: 10247
SMILES:C(C1(O)C2CC(=O)C(C)=CC2c2c(O)cc(CCCCC)cc21)(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -16.502
InChIKey:KYTMSOFMNUOSBJ-UHFFFAOYSA-N
ID: 10248
SMILES:C1(C(CO)=C)CCC(C)=CC1c1c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -17.298
InChIKey:ALWCZTNAQUVJTB-UHFFFAOYSA-N