ID: 116824
SMILES:C(CCCc1cc2c(c(O)c1)C1C(C(C)=CCC=C1C)C2=O)(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 324.464
CB1 binding score: -15.378
InChIKey:JIPQGZUUBRSXOL-UHFFFAOYSA-N
ID: 116825
SMILES:CC(=CCc1c(O)c(C(=O)OCCc2ccccc2)c(CCC(=O)C)cc1O)CCC=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 464.602
CB1 binding score: -15.116
InChIKey:SGHHGWNULIQNFM-UHFFFAOYSA-N
ID: 116826
SMILES:CC(=CC)C(C(C)c1cc(O)c2c(c1)OC(C)(C)C1C2CC(C)=CC1)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.506
CB1 binding score: -15.879
InChIKey:MZTYSDOBDVZZKZ-UHFFFAOYSA-N
ID: 116827
SMILES:C(Oc1cc(O)c(C(CC(C)C)=O)c2c1C1C=C(C)CCC1C(C)(C)O2)CC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.532
CB1 binding score: -13.655
InChIKey:KARUHQINJDEMML-UHFFFAOYSA-N
ID: 116828
SMILES:c1(C2C(C(C)=C)CCC(C)=C2)c(O)cc(CCC=CC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.453
CB1 binding score: -16.783
InChIKey:KLHMMUUOWNJWQU-UHFFFAOYSA-N
ID: 116829
SMILES:CCCCCc1ccc(O)c(C2C(C(C)C)CCC(C)=C2)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids;Sesquiterpenoids
Class: Cadinane sesquiterpenoids;Cannabinoids
MW: 300.486
CB1 binding score: -18.255
InChIKey:FVMNSBXLYRKHTD-UHFFFAOYSA-N
ID: 116830
SMILES:C1C=C(C(O)=O)C(CCC2(C)Oc3c(O)cc(CCCCC)cc3OC2(C)C)C2(C)CCC(O)C(C)(C)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 528.73
CB1 binding score: Not available
InChIKey:XZPBCYRVNPXJPD-UHFFFAOYSA-N
ID: 116831
SMILES:CC(C1C(c2c(O)cc(CCC)cc2O)C=C(C)CC1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.431
CB1 binding score: -20.128
InChIKey:YOJPFISTURZHJT-UHFFFAOYSA-N
ID: 116832
SMILES:O1c2cc(C)cc(O)c2C2C(=C1C)CC(C)(C)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 244.334
CB1 binding score: -17.663
InChIKey:GFNYWMONHPRLGE-UHFFFAOYSA-N
ID: 116833
SMILES:C12C(C)C(=O)OC1c1c(cc(CCCCC)cc1O)O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 276.332
CB1 binding score: -17.443
InChIKey:DCTLGTFZMPECPG-UHFFFAOYSA-N
ID: 116834
SMILES:C1C(O)C2(O)c3c(O)cc(CCCCC)cc3OC(C)(C)C2CC1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 334.456
CB1 binding score: -16.713
InChIKey:XDHRXIKZZVMNKU-UHFFFAOYSA-N
ID: 116835
SMILES:C(CC(C(C)=C)O)C(O)(C)CCc1c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids;Aromatic polyketides
Class: Cannabinoids;Catechols with side chains
MW: 350.499
CB1 binding score: -15.704
InChIKey:LRDCNSCGGLBDES-UHFFFAOYSA-N
ID: 116836
SMILES:C(C)(CCC=C(C)C)=CCc1c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.666
InChIKey:QXACEHWTBCFNSA-UHFFFAOYSA-N
ID: 116837
SMILES:C(CC=Cc1cc(O)c2c(c1)OC(C)(C)C1CCC(C)=CC12)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.453
CB1 binding score: -18.334
InChIKey:HJRYMUQWODLWCL-UHFFFAOYSA-N
ID: 116838
SMILES:c1c(CO)c2c(c(C)c1O)C1C=C(C)CCC1C(CO)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.386
CB1 binding score: -15.72
InChIKey:JACDBCVVSGZHMB-UHFFFAOYSA-N
ID: 116839
SMILES:C(c1cc(OC)c(C2C=C(C)CCC2C(C)C)c(O)c1)CCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -17.407
InChIKey:SMMGTDCVIQYVOD-UHFFFAOYSA-N
ID: 116840
SMILES:c1(O)c2c(cc(C)c1O)C1C=C(C)CCC1C(C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.36
CB1 binding score: -17.186
InChIKey:XWMNHGVOSIHLHJ-UHFFFAOYSA-N
ID: 116841
SMILES:C1(C)=CC(c2cc(CCCCC)cc(O)c2)(OC)C(C(C)=C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -15.921
InChIKey:USAJCCKZHWEKKT-UHFFFAOYSA-N
ID: 116842
SMILES:CC1(C)C2(C)Oc3cc(CCCCC)cc(O)c3C2CC1C(C)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -12.506
InChIKey:HFEWWWIWCMLDSP-UHFFFAOYSA-N
ID: 116843
SMILES:CC1(C)C2C1CC(C)C(=O)c1c2c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -16.438
InChIKey:QZDPPSDQSHPGBZ-UHFFFAOYSA-N
ID: 116844
SMILES:c1c(O)c(CCCCC)cc2c1OC(CCC=C(C)C)(C)C=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -17.518
InChIKey:RKWVJLADBILOBU-UHFFFAOYSA-N