ID: 32950
SMILES:C(CCc1cc(O)c2c(c1)OC(C)(C)C1=C2C=C(C)CC1)=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Miscellaneous meroterpenoids
MW: 324.464
CB1 binding score: -16.457
InChIKey:GIEQQXQFRCKVPI-UHFFFAOYSA-N
ID: 32951
SMILES:OCC1(C)C2CCC(C)=CC2c2c(cc(CCCCC)cc2O)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -19.583
InChIKey:AFSGVVWOXYAPKB-UHFFFAOYSA-N
ID: 32952
SMILES:Oc1cc(O)c(C(CC(C)C)=O)c2c1C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -17.385
InChIKey:KCKFCLWTUCSIQS-UHFFFAOYSA-N
ID: 32953
SMILES:CC1=Cc2c(O)c(C=O)c(CCCCC)cc2OC1(C)CCC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 356.506
CB1 binding score: -13.995
InChIKey:YFMQCFFWLJDLRT-UHFFFAOYSA-N
ID: 32954
SMILES:C1CC2(C)CC3c4c(cc(CCCCC)cc4O)OC(C)(C)C1C3CC(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.588
CB1 binding score: -12.697
InChIKey:MDZPJUZSJHVZHK-UHFFFAOYSA-N
ID: 32955
SMILES:CC1(C)Oc2c(c(O)cc(CCCCC)c2)C2=C(CC1)C(C)CC(=O)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -13.186
InChIKey:ZUFUYTNAVBOEEI-UHFFFAOYSA-N
ID: 32956
SMILES:ClC(CCl)(CC(c1c(O)cc(CC)cc1O)C1OC(C)(C)CC1)CCC(C)(C)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 447.443
CB1 binding score: -14.15
InChIKey:KIVOKHWTDVGMTE-UHFFFAOYSA-N
ID: 32957
SMILES:C(C)(=O)C1C2C(CC1)C(C)(C)Oc1c2c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -19.141
InChIKey:DJDLKJKQWPYHLY-UHFFFAOYSA-N
ID: 32958
SMILES:C(CCC)c1cc(O)c2c(c1)OC(C)(C)C1CC=C(C)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -20.175
InChIKey:RVWTXSLOGRTPEH-UHFFFAOYSA-N
ID: 32959
SMILES:C1C(C)CC(=CC(C)C)c2c1c(O)cc(CCC)c2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.405
CB1 binding score: -14.91
InChIKey:BTIDTJJQDHSXBX-UHFFFAOYSA-N
ID: 32960
SMILES:c1(O)c2c(cc(CO)c1)OC(C)(C)C1CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.36
CB1 binding score: -18.023
InChIKey:QIUUOTOYUFAURB-UHFFFAOYSA-N
ID: 32961
SMILES:C(CCC)Cc1cc2c(c(O)c1)C1CC(C)(CCC1C(=C)C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -18.198
InChIKey:NUXUDGMVYZUFNQ-UHFFFAOYSA-N
ID: 32962
SMILES:Oc1cc2c(cc1C)OC1(C)OC23C(CC1)C(C)(C)Oc1cc(C)cc(O)c13
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.456
CB1 binding score: -15.062
InChIKey:WQZKSSPEXOHZJM-UHFFFAOYSA-N
ID: 32963
SMILES:CC1(C)Oc2c(c(OS(=O)(O)=O)c(CCC)cc2O)C2C(CC=C(C)C2O)C1C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 426.531
CB1 binding score: -13.599
InChIKey:WPVPEZMFNGNYTH-UHFFFAOYSA-N
ID: 32964
SMILES:C1CC2(C)C(C1C(C)(O)C)Oc1c(c(O)cc(CCCCC)c1)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -16.05
InChIKey:QTVNBKQGCLTBKE-UHFFFAOYSA-N
ID: 32965
SMILES:Cc1c(C(=O)OC=C(C)C=C)c(O)c2c(c1)OC(C)(C)C1CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 368.473
CB1 binding score: -14.988
InChIKey:LVCZDBVROSQPRZ-UHFFFAOYSA-N
ID: 32966
SMILES:Oc1c(OC)c(C2C=C(C)CCC2C(C)=C)c(O)cc1CCc1ccccc1
Pathway: Shikimates and Phenylpropanoids;Terpenoids
Superclass: Meroterpenoids;Stilbenoids
Class: Cannabinoids;Monomeric stilbenes
MW: 378.512
CB1 binding score: -15.089
InChIKey:FTLLURNRCOTUMQ-UHFFFAOYSA-N
ID: 32967
SMILES:C12C(C)(C)Oc3c(c(O)ccc3)C1CC(C)CC2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 246.35
CB1 binding score: -17.488
InChIKey:FXKRYASJSKNWGO-UHFFFAOYSA-N
ID: 32968
SMILES:c1c(CCCCC)cc2c(c1O)C1C(CC=C(C)C1)C2(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.47
CB1 binding score: -17.334
InChIKey:YNNFYMQFHNFBDP-UHFFFAOYSA-N
ID: 32969
SMILES:Oc1cc(CCCCC)cc2c1C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 32970
SMILES:C1C2C(c3c(cc(CCCCC)cc3O)OC2(C)C)C(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.458
CB1 binding score: -19.029
InChIKey:HCVJHHUJBXZYBI-UHFFFAOYSA-N