ID: 114745
SMILES:C1C(C)=CC(c2cc(O)c(C)cc2O)C(C(=C)C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -19
InChIKey:VCUWNGMQOOFWFS-UHFFFAOYSA-N
ID: 114746
SMILES:C1=C(C)CCC(C(C)C)(Oc2cc(CCCCC)cc(Br)c2)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 379.382
CB1 binding score: -14.03
InChIKey:NBRJVSLHYPITBA-UHFFFAOYSA-N
ID: 114747
SMILES:C1C(C(=C)C(=O)OC2C(C(C)C)CCC(C)C2)c2c(O)cc(CCCCCC)cc2OC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 442.64
CB1 binding score: -15.391
InChIKey:QHESURTVRXBBBA-UHFFFAOYSA-N
ID: 114748
SMILES:C(CC(C)CCCc1ccccc1)(=O)c1cc(O)c(CC=C(CCC=C(CO)C)C)c(O)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 450.619
CB1 binding score: -14.91
InChIKey:JDWDQWBMMAUEGG-UHFFFAOYSA-N
ID: 114749
SMILES:c1c(O)c(C2C=C(C)CCC2C(=C)C)c(O)c(C(=O)C(C)CC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -16.502
InChIKey:GAPLVBPBSXUGJI-UHFFFAOYSA-N
ID: 114750
SMILES:C1CCC2(c3c(O)c(OC(=O)C)c(CCCCC)cc3OC2(C)C)C1(CO)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 392.492
CB1 binding score: -13.643
InChIKey:NZWAWKKLANPKEO-UHFFFAOYSA-N
ID: 114751
SMILES:C=C(C)C1=CCC(C)CC1c1c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -16.995
InChIKey:LHLICFIVOBVHOL-UHFFFAOYSA-N
ID: 114752
SMILES:c12c(cc(CCCCC)cc1O)OC1(C2=O)CC(O)C(C)=CC1(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -14.708
InChIKey:QTEQBAWOZKGZBD-UHFFFAOYSA-N
ID: 114753
SMILES:c12c(O)cc(CCCCCC)cc1C1C=C(CCC=C(C)CC2O)C(=O)C(C)(C)C1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 426.597
CB1 binding score: -16.523
InChIKey:FCVRDBFTUBMLNN-UHFFFAOYSA-N
ID: 114754
SMILES:c12c(O)cc(CCCCC)cc1C1(O)C(C(C)(C)O2)CCC(O)(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 348.483
CB1 binding score: -14.656
InChIKey:MVVCOHVHBWHYFR-UHFFFAOYSA-N
ID: 114755
SMILES:C12C(C)(C)Oc3c-c(C)c(Br)cc3C1C=C(C)CC2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 321.258
CB1 binding score: -18.671
InChIKey:RPVWNWGEPFZWQS-UHFFFAOYSA-N
ID: 114756
SMILES:c12c(cc(C)cc1O)OC1(C2(C)C)CCC(C)=CC1=O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.344
CB1 binding score: -17.327
InChIKey:VPZVJTNMLPXTBW-UHFFFAOYSA-N
ID: 114757
SMILES:CC1(C)C(OC(=O)C)CCC23C1Cc1c(cc(CCCCC)cc1OC2=O)O3
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.488
CB1 binding score: -11.729
InChIKey:FJAFHGNJWVBJKZ-UHFFFAOYSA-N
ID: 114758
SMILES:C(C)(=O)OC1C(CO)=CC2c3c(cc(CCCCCC)cc3O)OC(C)(C)C2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 402.531
CB1 binding score: -12.246
InChIKey:VBDUOHMDNWLXKC-UHFFFAOYSA-N
ID: 114759
SMILES:C1CC(C(=C)C)C(c2c(O)c(O)cc(CC=C(CCC=C(C)C)C)c2OC)C(CC(O)C)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 458.639
CB1 binding score: -16.11
InChIKey:OYOBYIJUWWKYJN-UHFFFAOYSA-N
ID: 114760
SMILES:C(CCCc1cc(O)c(C2C=C(C)CCC2C(C)=C)c(O)c1)CC(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.55
CB1 binding score: -15.358
InChIKey:MHTQVUDOUQLGDN-UHFFFAOYSA-N
ID: 114761
SMILES:CC1(C)Oc2cc(CCCCC)cc(O)c2CC1O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 264.365
CB1 binding score: -19.729
InChIKey:GIIVGKMZIUKMMN-UHFFFAOYSA-N
ID: 114762
SMILES:CC(C)=CCc1c2c(cc(CCCCC)c1)OC(CCCC(C)(O)C)(C)C=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.604
CB1 binding score: -13.709
InChIKey:YPYCSSYSBABYLV-UHFFFAOYSA-N
ID: 114763
SMILES:C1(C)(C)C2CCC3(C)C2C1c1c(O)cc(C(C)CC(CO)C)cc1OC3(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.576
CB1 binding score: -16.929
InChIKey:GLTDVDJJDOFZFE-UHFFFAOYSA-N
ID: 114764
SMILES:O=C1C2C(C)(C)Oc3cc(CCC)cc(O)c3C2C=C(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.398
CB1 binding score: -15.131
InChIKey:UVZSAOTYTXWTKX-UHFFFAOYSA-N
ID: 114765
SMILES:c1(C(CO)(COC(C)=O)CCC=C(C)C)cc(O)c2c(c1)OC(C)(C)C1C2CC(C)=CC1=O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 456.579
CB1 binding score: -14.762
InChIKey:YHVOWZDRBKJMCE-UHFFFAOYSA-N