ID: 48553
SMILES:C1(C)=CCC2C(c3c(O)cc(CCCCC)cc3OC2(C)C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.453
CB1 binding score: -18.957
InChIKey:BXBPYYDKENEJGP-UHFFFAOYSA-N
ID: 48554
SMILES:C1(C(C)C)C(c2c(O)cc(CCCCCO)cc2O)C=C(CO)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 348.483
CB1 binding score: -17.616
InChIKey:YJLNKQZBIIPWNP-UHFFFAOYSA-N
ID: 48555
SMILES:c1(C(=O)OC)c(O)c2c(cc1C(C)CO)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.45
CB1 binding score: -13.488
InChIKey:MICLBYHFEYWSGS-UHFFFAOYSA-N
ID: 48556
SMILES:C(CCC)Cc1cc(O)c2c(c1)C1=C(C(C)(C)O2)CCC(C)C1=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.48
CB1 binding score: -14.463
InChIKey:NTXPWWRQUYBYFS-UHFFFAOYSA-N
ID: 48557
SMILES:CC1(C)C(c2c(O)cc(CCCCC)cc2O)C=C(C)CCC1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -15.689
InChIKey:FKDTZNJOXRCJFV-UHFFFAOYSA-N
ID: 48558
SMILES:Oc1c(C=O)c2c(c(O)c1)C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.343
CB1 binding score: -17.321
InChIKey:CMBFQSLUVVLKBC-UHFFFAOYSA-N
ID: 48559
SMILES:CC(CC(c1c(O)c2c(cc1O)OC(C)(C)C1CCC(C)=CC12)=C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -13.741
InChIKey:PLOYZMVDHQYYMN-UHFFFAOYSA-N
ID: 48560
SMILES:C(OP(=O)(O)O)C1(C)C2CC=C(C)CC2c2c(cc(C)cc2O)O1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 354.339
CB1 binding score: -15.929
InChIKey:KBDJCQLQMGMAAD-UHFFFAOYSA-N
ID: 48561
SMILES:C(c1cc2c(c(C=C(C=O)C)c1)OC(C)(C)C1CCC(C)=CC21)C(O)=O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 354.446
CB1 binding score: -12.98
InChIKey:CGCOWZSSGYSSKW-UHFFFAOYSA-N
ID: 48562
SMILES:C(CCCC)c1cc2c(c(O)c1)C1CC(C)(O2)CCC1C(CC=CC(O)(CCC=C(C)C)C)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 470.694
CB1 binding score: -16.015
InChIKey:MHYNJWZWXFICEJ-UHFFFAOYSA-N
ID: 48563
SMILES:C1=C(C)CCC(C(=C)C)C1c1c(O)cc(CCCC)cc1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 284.443
CB1 binding score: -19.478
InChIKey:UELYWRAKVJEDIL-UHFFFAOYSA-N
ID: 48564
SMILES:c12c(c(CC=C(C)C)cc(CC=C)c1-c1c(Cl)cc(C)cc1O)OC(C)(C)C1C2C=C(C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 477.088
CB1 binding score: -14.516
InChIKey:IGZAURURUJOUSK-UHFFFAOYSA-N
ID: 48565
SMILES:CC1(C)C2CCC(C)=CC2c2c(O)cc(CCCCC)cc2O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 48566
SMILES:C1(C)C2CC(C(=O)C)CC2(O)c2c(O)cc(CCCCC)cc2O1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.44
CB1 binding score: -15.47
InChIKey:BRAVICYRLVYMPT-UHFFFAOYSA-N
ID: 48567
SMILES:COc1c(C2C(C(C)=C)CCC(C)=C2)ccc(O)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -18.701
InChIKey:QFYIYBNVAPLEFO-UHFFFAOYSA-N
ID: 48568
SMILES:C1C=C(C)CCC2C(C)(C)Oc3cc(CCCCC)cc(O)c3C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -18.15
InChIKey:FXRYFSBEEDYORZ-UHFFFAOYSA-N
ID: 48569
SMILES:CC(=CCOc1cc(CCCCC)cc(O)c1)C=C
Pathway: Polyketides
Superclass: Meroterpenoids;Aromatic polyketides
Class: Cannabinoids;Catechols with side chains
MW: 260.377
CB1 binding score: -17.093
InChIKey:GFWRINTVNXWIJA-UHFFFAOYSA-N
ID: 48570
SMILES:c1(COCc2ccccc2)cc(OC)c2c(c1)OC(C)(C)C1C2C=C(C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 378.512
CB1 binding score: -16.498
InChIKey:PILMROPVMRTTIM-UHFFFAOYSA-N
ID: 48571
SMILES:c12c(cc(CCCCC)cc1O)OC(C)(C)C=C2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 246.35
CB1 binding score: -20.081
InChIKey:XLSYFQOJMWXOCT-UHFFFAOYSA-N
ID: 48572
SMILES:C1(C)=CC(c2ccc(CCCCC)cc2)C(C(C)C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 284.487
CB1 binding score: -19.108
InChIKey:KCGRQTUOQYSEJY-UHFFFAOYSA-N
ID: 48573
SMILES:c1(CCCCC)cc2c(cc1O)OC(C)(C)C1=C2C(=O)C(C)=CC1=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 340.419
CB1 binding score: -15.949
InChIKey:VAUXNGQSHDCACH-UHFFFAOYSA-N