ID: 95215
SMILES:CC1CCC2(O)C(C)(C)Oc3cc(CCCCC)cc(O)c3C2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -19.071
InChIKey:UGLNUKBERGJBMI-UHFFFAOYSA-N
ID: 95216
SMILES:CC(C)=CCc1c(O)c(C2OC(CCCC)(C)CC2)c(O)c2c1OC(C)(C)C1C2CC(C)(O)C(Cl)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 521.138
CB1 binding score: -11.943
InChIKey:BPHMOSKUSSEWIX-UHFFFAOYSA-N
ID: 95217
SMILES:C(C)(CCCC(C)(c1cc2c(c(O)c1)C(C)CC(=O)O2)C)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.43
CB1 binding score: -13.021
InChIKey:XTCADSJTPIPHDU-UHFFFAOYSA-N
ID: 95218
SMILES:C(=CCc1c2c(c(=O)c3c(c1)OC(CCC=C(C)C)(C)C=C3)C(C)(C)OC(=O)C2)=Cc1cc(O)cc(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 514.618
CB1 binding score: -15.916
InChIKey:GYCQFCIRBJLCJL-UHFFFAOYSA-N
ID: 95219
SMILES:C1C(C(=C)C)C(c2c(CCCCC)cc(O)cc2O)C=C(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.677
InChIKey:YWEZXUNAYVCODW-UHFFFAOYSA-N
ID: 95220
SMILES:O=C(O)C(C)=CC1C=C(C)CC(c2c(O)cc(CCCCC)cc2O)C(CO)C1=O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 416.514
CB1 binding score: -14.829
InChIKey:MIMGCUUBAFVHFP-UHFFFAOYSA-N
ID: 95221
SMILES:CC1CCC2C(C)(C)Oc3c(c(O)cc(CCCCC)c3)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.458
CB1 binding score: -19.029
InChIKey:HCVJHHUJBXZYBI-UHFFFAOYSA-N
ID: 95222
SMILES:C(C1CCC(C)=CC1c1c(O)cc(CCCCC)cc1O)(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.815
InChIKey:PCXRACLQFPRCBB-UHFFFAOYSA-N
ID: 95223
SMILES:c12c(C(N)=O)cccc1C1C(C(C)(C)Oc3cc(CCCCC)cc(O)c31)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 379.5
CB1 binding score: -14.112
InChIKey:PFFVTGRTJMDBDF-UHFFFAOYSA-N
ID: 95224
SMILES:C1(C2C(CCCl)(O)C(C)(C)Oc3c2c(O)cc(CCCCC)c3)=C(C)CCC2C1(C)CCC(C(O)(C)C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 549.192
CB1 binding score: -15.334
InChIKey:YTHVELVLXTYCFT-UHFFFAOYSA-N
ID: 95225
SMILES:C1C(C(=C)C)C(c2c(O)cc(CCCO)cc2O)C=C(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.414
CB1 binding score: -17.634
InChIKey:XATUYSLLQMJNDN-UHFFFAOYSA-N
ID: 95226
SMILES:c1c(OC)c2c(c(C(OC)=O)c1CCCCC)OC(C)(C)C1CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.532
CB1 binding score: -16.733
InChIKey:ZMSSJLKDQVXRQM-UHFFFAOYSA-N
ID: 95227
SMILES:C1(O)C(C)(C)C2(C)C(C)(CC1)Oc1c(c(O)cc(CCCCC)c1)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.511
CB1 binding score: -12.741
InChIKey:QENICWYHMOOPMG-UHFFFAOYSA-N
ID: 95228
SMILES:C1C(=C)CCC(C(C)C)C1c1c(OC)cc(CCCCCCCC)cc1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.594
CB1 binding score: -13.183
InChIKey:HKMUARFSTBIDOQ-UHFFFAOYSA-N
ID: 95229
SMILES:c1c(O)c(O)cc2c1-c1c(O)cc(CCCC)cc1OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.381
CB1 binding score: -17.787
InChIKey:BQZUVGRFFGANOZ-UHFFFAOYSA-N
ID: 95230
SMILES:c1cc(O)cc2c1OC(C)(C)C1CCC(C)=CC12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 244.334
CB1 binding score: -20.067
InChIKey:OBJJEVJNCDBGOD-UHFFFAOYSA-N
ID: 95231
SMILES:c12c(cc(CCCCC)cc1O)OC(C)(C)C1C2CC(C)(O)C(O)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 348.483
CB1 binding score: -17.774
InChIKey:GKYGKYSJIDSYCQ-UHFFFAOYSA-N
ID: 95232
SMILES:C1C(C)C2C(C1)C(C)(C)Oc1cc(CCCCC)cc(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.458
CB1 binding score: -19.029
InChIKey:HCVJHHUJBXZYBI-UHFFFAOYSA-N
ID: 95233
SMILES:CC(CCC=C(C)C)=CCc1c(O)c(C(=O)O)c(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -19.234
InChIKey:SEEZIOZEUUMJME-UHFFFAOYSA-N
ID: 95234
SMILES:c1(CC(O)C(O)(C)C)c(O)c2c(c(CC=C(C)C)c1O)OC(C)(C)C1CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 430.585
CB1 binding score: -13.594
InChIKey:IDPUJVAVLVEWIC-UHFFFAOYSA-N
ID: 95235
SMILES:CC1=CC(c2c(O)ccc(O)c2)C(C(=CCC=C(C)C)C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.453
CB1 binding score: -17.465
InChIKey:OJYOTZWFSYIQBL-UHFFFAOYSA-N