ID: 53173
SMILES:C(C)CCCc1cc2c(c(O)c1)C1C(O)C(C)=CCC1(C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -18.814
InChIKey:VAPPATJCTDQPOB-UHFFFAOYSA-N
ID: 53174
SMILES:c1(C=O)cc2c(c(O)c1)C1C(CCC(C)=C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.344
CB1 binding score: -19.395
InChIKey:VTKCSOVWESGERA-UHFFFAOYSA-N
ID: 53175
SMILES:C1(C)=CCCC(=C)C2C(CC1)C(C)(C)Oc1c2c(OC)cc(C)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.48
CB1 binding score: -12.85
InChIKey:FKRGKZPKKPPTFN-UHFFFAOYSA-N
ID: 53176
SMILES:BrCCCCCCc1cc2c(c(O)c1)C1C(C(C)(C)O2)O1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 355.272
CB1 binding score: -14.292
InChIKey:GEXNWAWIVDXHDO-UHFFFAOYSA-N
ID: 53177
SMILES:CC(C)=CCc1c(O)cc2c(c1O)C1C(CC2)C(C)(C)Oc2c-1cc(OC)cc2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 394.511
CB1 binding score: -16.199
InChIKey:OQAFHIDYQQETMM-UHFFFAOYSA-N
ID: 53178
SMILES:C1(C(C)CCC=C(C)C)=CC2OC(C)(C)OC3c4c(O)c(C(O)=O)c(C)cc4OC(C)(C)C4C2(CC4C)C3(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 566.779
CB1 binding score: -15.385
InChIKey:LLIXQTBIBLMRDV-UHFFFAOYSA-N
ID: 53179
SMILES:O1c2c(cc(C)c(O)c2)C2C=C(C)CCC2C1(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -18.07
InChIKey:JAQQPODSAWTCBC-UHFFFAOYSA-N
ID: 53180
SMILES:C(C)(=CCCC1(C)Oc2cc(CCCCC)c(O)c(O)c2C2C1CC(O)C(C)(O)C2)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 432.601
CB1 binding score: -13.311
InChIKey:RMCHUKUKDFRYGT-UHFFFAOYSA-N
ID: 53181
SMILES:C(CCCC)c1cc(O)c2c(c1)OC(C)(C)C1Cc3c(c(cc(OC(C)=O)c3Br)C(C)C)C=CC(C)(C)OC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 599.606
CB1 binding score: -13.811
InChIKey:JCWKLKDEAWFYCZ-UHFFFAOYSA-N
ID: 53182
SMILES:C1=C(C)CCc2c(O)cc(CCCCC)cc21
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 230.351
CB1 binding score: -16.228
InChIKey:HKWBDZPJSMDFHI-UHFFFAOYSA-N
ID: 53183
SMILES:c1(CCCCC)cc(Cl)c(C2C(C(=C)C)CC(O)C(C)=C2)ccc1=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.925
CB1 binding score: -14.938
InChIKey:MWIJLGTYRFLWFJ-UHFFFAOYSA-N
ID: 53184
SMILES:c1(O)cc(C)cc2c1C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -20.957
InChIKey:WIDIPARNVYRVNW-UHFFFAOYSA-N
ID: 53185
SMILES:O1c2c(c(O)cc(CCCCC)c2)C2(C)C(C)CCC3C2=C1C(C)(C)C(=O)C(C3)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 412.57
CB1 binding score: -14.855
InChIKey:AEUNGMJHBMUOFP-UHFFFAOYSA-N
ID: 53186
SMILES:Oc1c(C(C(=O)CC)C)c(O)c(O)c2c1OC1(CC=C(CCC=C(CCC=C(C)C)C)CO1)C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 470.606
CB1 binding score: -16.218
InChIKey:RGSWPQSLDBQPGT-UHFFFAOYSA-N
ID: 53187
SMILES:OC1C(C)=CC2c3c(cc(CCCCC)cc3O)OC(C)(C)C2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -19.534
InChIKey:INKUWBOHCFHXTJ-UHFFFAOYSA-N
ID: 53188
SMILES:C1(C(O)CCC(C)=CCc2cc(OC)cc(C)c2O)(C)OC(C(C)(C)O)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 392.536
CB1 binding score: -16.191
InChIKey:IPTNTRJWINZYHG-UHFFFAOYSA-N
ID: 53189
SMILES:C1(C(C)=C)C(c2c(O)cc(CCC)cc2O)CC(C)=C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.388
CB1 binding score: -12.549
InChIKey:JGYYBGCBHGJENI-UHFFFAOYSA-N
ID: 53190
SMILES:CC1(C)Oc2c(c(O)c(CCCCC)c(C=O)c2O)C2C1CCC(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -14.416
InChIKey:VQXLFLMRINKBCD-UHFFFAOYSA-N
ID: 53191
SMILES:C1CC12C(C)(C)Oc1c(c(OC)cc(CCCCC)c1)C(C)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -17.385
InChIKey:PCYSIKKTCVUNHK-UHFFFAOYSA-N
ID: 53192
SMILES:C1CC2C(C)(C)Oc3cc(CCCC)cc(O)c3C2C=C1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -20.843
InChIKey:QHCQSGYWGBDSIY-UHFFFAOYSA-N
ID: 53193
SMILES:C(=O)C1=CCC2C(C)(C)Oc3c2c(O)cc(CCCC)c31
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.371
CB1 binding score: -14.61
InChIKey:VGCCONAGUSMVRT-UHFFFAOYSA-N