ID: 129487
SMILES:C12C(C)(C)Oc3c(cc(CCCCC)cc3O)C1C(O)C(C)=CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -16.502
InChIKey:ZWVABWHGDYDNGQ-UHFFFAOYSA-N
ID: 129488
SMILES:C(CCCc1cc2c(c(OC)c1)C1C(=C(C)C)CCC(C)(O)C1CC=C(C)C2)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 396.615
CB1 binding score: -17.259
InChIKey:VYGFGWAOLOZDDC-UHFFFAOYSA-N
ID: 129489
SMILES:c1c(O)c2c(c(O)c1)C1C=C(C)CCC1C(C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 260.333
CB1 binding score: -18.988
InChIKey:FDECQIAQAVZRFF-UHFFFAOYSA-N
ID: 129490
SMILES:C1(=O)C(C)=C(c2c(CCCCC)cc(O)c3c2CC2C(C(C)=C)CCC(C)C23)C(C)(C)C1=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 448.647
CB1 binding score: -15.116
InChIKey:GUDCZNXVVFLQJA-UHFFFAOYSA-N
ID: 129491
SMILES:C1(c2c3c(cc(C(C(C)CC)=O)c2O)OC(C)(C)C(O)C3)CC(C)(C)OO1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 378.465
CB1 binding score: -14.817
InChIKey:PBYKVBPKMWMBEL-UHFFFAOYSA-N
ID: 129492
SMILES:C(CC)CCCCc1c(O)c(C2C=C(C)CCC2C(C)=C)c2c(o1)c(O)cc2O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.543
CB1 binding score: -16.798
InChIKey:RYVFRAWUUBRQHK-UHFFFAOYSA-N
ID: 129493
SMILES:OC(c1c(O)cc(CCCCC)cc1OC)(C)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 252.354
CB1 binding score: -17.206
InChIKey:MTHXKGTZLHAXKH-UHFFFAOYSA-N
ID: 129494
SMILES:OC1(C)C2Oc3c(c(O)cc(C(C)(C)CC)c3)C2C(C(C)C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -15.609
InChIKey:MIPBYAQFMMCJHD-UHFFFAOYSA-N
ID: 129495
SMILES:c12c(O)cc(CCCCC)cc1OC(C)(C)C1CCC(C)(O)C(O)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 348.483
CB1 binding score: -19.298
InChIKey:TZGCTXUTNDNTTE-UHFFFAOYSA-N
ID: 129496
SMILES:C1(C)(O)CCc2c(O)cc(CCCCC)cc2OC(C)(C)C(O)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 350.499
CB1 binding score: -12.268
InChIKey:GOILKIIYJBPBCM-UHFFFAOYSA-N
ID: 129497
SMILES:C1C=C(C)CC2C1C(C)(C)Oc1c2cc(C(C)C)c2cc(C)cc(O)c12
Pathway: Terpenoids
Superclass: Meroterpenoids;Sesquiterpenoids
Class: Cadinane sesquiterpenoids;Cannabinoids
MW: 350.502
CB1 binding score: -15.738
InChIKey:KRQMIMBSLNJYJY-UHFFFAOYSA-N
ID: 129498
SMILES:C12c3c(O)cc(CCCCC)cc3OC(C)(C)C1CCC(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 129499
SMILES:C(Cc1cc(C(=O)O)cc2c1OC(C)(C)C1CCC(C)CC12)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -12.987
InChIKey:OHYKDXWGFZKIKR-UHFFFAOYSA-N
ID: 129500
SMILES:C(CCc1cc(OC)c(C)c(O)c1)C1=CCCC(C)=CC(C)(C(CO)=C)C(C)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.587
CB1 binding score: -14.218
InChIKey:NLYXAXCHACGGSQ-UHFFFAOYSA-N
ID: 129501
SMILES:C1(=O)C2C(C3(C)C(C1O)C(C)(C)C(OC(C(C)=CC)=O)CC3=O)Oc1c2c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 498.616
CB1 binding score: -16.164
InChIKey:HUCJVDLPANSFEA-UHFFFAOYSA-N
ID: 129502
SMILES:CC1CCC(C(C)=C)C(c2c(O)cc(CCC)cc2O)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.431
CB1 binding score: -19.57
InChIKey:LURPWARMGYBTPS-UHFFFAOYSA-N
ID: 129503
SMILES:c1(O)cc(CC=C(C)CCC=C(C)[CH])c(O)cc1CCCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids;Aromatic polyketides
Class: Cannabinoids;Catechols with side chains
MW: 314.469
CB1 binding score: -16.924
InChIKey:LCOHIWYTVJUAST-UHFFFAOYSA-N
ID: 129504
SMILES:C(C=C(C)CCC(O)C(C)(O)C)c1c(O)cc(CCCCC)c(C(=O)O)c1O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 394.508
CB1 binding score: -16.844
InChIKey:DXMRIITZCLCWPZ-UHFFFAOYSA-N
ID: 129505
SMILES:C(C)(C1CCC(C)=CC1c1c(O)cc(CCC)cc1O)CCC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.55
CB1 binding score: -18.334
InChIKey:XBCSXUYXVCTQRG-UHFFFAOYSA-N
ID: 129506
SMILES:c12c(O)cc(CCCCC)cc1OC(C)(C)C1CCC(C)C=C21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -17.727
InChIKey:YLTWYAXWDLZZCU-UHFFFAOYSA-N
ID: 129507
SMILES:Oc1c(C2C(C(=C)C)CCC(C)=C2)c(O)cc(C)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -18.979
InChIKey:GKVOVXWEBSQJPA-UHFFFAOYSA-N