ID: 43849
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: 43850
SMILES:c1c2c(cc(CCCCC)c1)OC(C)(C)C1CC(=O)C(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.453
CB1 binding score: -17.164
InChIKey:JKVPITCSYOZMNN-UHFFFAOYSA-N
ID: 43851
SMILES:CC1C2=C(c3c(cc(CCCCC)c(O)c3OC)O1)C(C)CCC2=C(C)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.533
CB1 binding score: -12.127
InChIKey:SXLRVMRGDODMQH-UHFFFAOYSA-N
ID: 43852
SMILES:C(C)CCCc1cc2c(c(O)c1)C1C(C(C)=C)CCC(C)(O2)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -18.198
InChIKey:NUXUDGMVYZUFNQ-UHFFFAOYSA-N
ID: 43853
SMILES:C(C)Cc1cc(O)c2c(c1Cl)OC13C(C(C)(C)O1)CCC(C)(O3)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 366.885
CB1 binding score: -14.605
InChIKey:ADRWUHQXFNZNPX-UHFFFAOYSA-N
ID: 43854
SMILES:C(CCCC)c1c(C(O)=O)c(O)c(CC=C(CCC=C(C)C)C)c(OC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.521
CB1 binding score: -19.037
InChIKey:VAFRUJRAAHLCFZ-UHFFFAOYSA-N
ID: 43855
SMILES:Cc1cc2c(cc1)OC(C)(C)C1C2C=C(C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 242.362
CB1 binding score: -18.878
InChIKey:GUXGXKFPIHIMLU-UHFFFAOYSA-N
ID: 43856
SMILES:CC1(C)OCC2(C)Oc3c(c(O)cc(CCCCC)c3)C12
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 290.403
CB1 binding score: -15.805
InChIKey:CCAICQHPEHSIKM-UHFFFAOYSA-N
ID: 43857
SMILES:C(CCC)Cc1cc2c(c(O)c1)C1C(C(C)(O)CO)CCC(C)(O2)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 348.483
CB1 binding score: -15.977
InChIKey:VZPHUIRXRJKYHE-UHFFFAOYSA-N
ID: 43858
SMILES:CC1(CCC2C(C)(C)O2)Oc2c(O)cc(CCCC(O)C)c(C(=O)O)c2C=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 390.476
CB1 binding score: -17.19
InChIKey:BXLYVWCZERCBQS-UHFFFAOYSA-N
ID: 43859
SMILES:CC12c3c(O)cc(CCCCC)cc3OC3(C1C(C)(C)C(OC(C)=O)CC3)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.532
CB1 binding score: -13.373
InChIKey:FWLJTRBBVLKUFC-UHFFFAOYSA-N
ID: 43860
SMILES:c1(=O)c(O)ccc2c(c1)OC(C)(C)C1CC=C(C)CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.344
CB1 binding score: -14.206
InChIKey:KIAXGNPYJJFDND-UHFFFAOYSA-N
ID: 43861
SMILES:C(C)(C)C(Cc1c2c3c(cc1)C=CC(C)(C)O3)OC(C)(C)C1C2C=C(C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids;Sesquiterpenoids
Class: Cadinane sesquiterpenoids;Cannabinoids
MW: 380.572
CB1 binding score: -14.568
InChIKey:BHNKEWVEWOHALD-UHFFFAOYSA-N
ID: 43862
SMILES:C1CC2(c3c(cc(CCCCC)cc3O)OC2(C)C)CC1(C)C=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -16.052
InChIKey:YSXMGHRYKZAYSJ-UHFFFAOYSA-N
ID: 43863
SMILES:C1(C=O)CCC2C1C(C)(C)Oc1c-2c(O)cc(C)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 260.333
CB1 binding score: -14.609
InChIKey:HWPXNYSEXNZUQG-UHFFFAOYSA-N
ID: 43864
SMILES:CC12C(C(C(C)(O)C)CC1)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: 43865
SMILES:OC1C2(O)C3(C(=O)C(CC)C)C(=O)OC(C)(C)C3CC(C(C)=C2)C1=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 350.411
CB1 binding score: -16.509
InChIKey:ZDHPSEWCGNNZLB-UHFFFAOYSA-N
ID: 43866
SMILES:c12c(O)c3c(cc1OCC2O)OC(C)(C)C1C3C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.37
CB1 binding score: -12.344
InChIKey:QVFSCXYQQFKDLM-UHFFFAOYSA-N
ID: 43867
SMILES:CCCCCCc1cc2c(c(O)c1)C1C(C(C)(C)O2)CCC(CO)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -18.264
InChIKey:JSQZQNWIVUSPJH-UHFFFAOYSA-N
ID: 43868
SMILES:C(=C(C)CCCC(C)COC(=O)C)c1c2c(c(O)c(C3C(=O)OC(C=C(C)C)C3)c1)OC(C)(C)C(O)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 514.659
CB1 binding score: -13.683
InChIKey:VOVBBOVYSBFMJK-UHFFFAOYSA-N
ID: 43869
SMILES:C=CCc1cc(O)c(Cc2c(O)c(CC=C(CCC=C(C)C)C)c(O)cc2CCCCC)c(O)c1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 478.673
CB1 binding score: -15.623
InChIKey:QXUJVLSJDFPKOM-UHFFFAOYSA-N