ID: 31690
SMILES:C1(C)(C)C(C(=O)Oc2ccccc2)CC2(CC=C(C)C=C2)C(C)(C)O1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 340.463
CB1 binding score: -15.777
InChIKey:WIDLSFNICWFGOE-UHFFFAOYSA-N
ID: 31691
SMILES:Oc1c(C)c2c3c(cc(CCCCC)c1)OC(C)(C)C1CCC(C)C(C21)O3
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.533
CB1 binding score: -18.79
InChIKey:JXMURBOWRFJMNE-UHFFFAOYSA-N
ID: 31692
SMILES:CC12CC(c3c(O)cc(CCCCCO)cc3O1)C(C(C)=C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -16.847
InChIKey:PTVZEFAGSDXGQO-UHFFFAOYSA-N
ID: 31693
SMILES:C1C(Cl)C(C)(C)Oc2c(c(O)cc(CCCCC)c2)C1OC(=O)C(=CC)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 394.939
CB1 binding score: -15.162
InChIKey:DWMZVRPJADGVCS-UHFFFAOYSA-N
ID: 31694
SMILES:C1(C(O)(C)C)C(c2c(O)cc(CCCCC)cc2O)C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -19.812
InChIKey:FTDORWGKHUOHKJ-UHFFFAOYSA-N
ID: 31695
SMILES:Cc1c2c(c(=O)c(O)cc1)OC(C)(C)C1C2C=C(C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.371
CB1 binding score: -15.266
InChIKey:MEUQGXDVCMEMEI-UHFFFAOYSA-N
ID: 31696
SMILES:CC1=CC(c2c(O)cc(CCCCC)cc2O)C(C(C)C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.815
InChIKey:PCXRACLQFPRCBB-UHFFFAOYSA-N
ID: 31697
SMILES:CC(=CCc1c(O)cc(CCCCC)c(C(=O)O)c1O)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 292.375
CB1 binding score: -19.394
InChIKey:IQDBYPKRWVDTCI-UHFFFAOYSA-N
ID: 31698
SMILES:C12(C)CCC(C(C)C)C1c1c(cc(CCCCC)c(I)c1O)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 428.354
CB1 binding score: -12.602
InChIKey:MZURBFNIROEUGG-UHFFFAOYSA-N
ID: 31699
SMILES:O=C1C(C)=CCCC1c1c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.387
CB1 binding score: -13.997
InChIKey:FOURNLRZNFQXLB-UHFFFAOYSA-N
ID: 31700
SMILES:c1c(CCCCC)cc2c(c1O)C1C(CC=C(C)C1)C=C2C=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 310.437
CB1 binding score: -13.957
InChIKey:ZSZWKAISRJKPNG-UHFFFAOYSA-N
ID: 31701
SMILES:C(CC(=O)O)(=O)Oc1c2c(cc(CCCCC)c1)OC(C)(C)C1CCC(O)(C)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 404.503
CB1 binding score: -13.895
InChIKey:NLVPIFQSKDZVJW-UHFFFAOYSA-N
ID: 31702
SMILES:c1(O)cc(CCCCC)c(OC)c2c1C1(O)CC(=O)C(C)(C)C(CC=C(C)C)C1=C2O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 428.569
CB1 binding score: -16.233
InChIKey:BVPPOXPNIDNFNO-UHFFFAOYSA-N
ID: 31703
SMILES:C(CCC)Cc1cc(O)c2c(c1)OC(C)(C)C1C2CC(=C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.055
InChIKey:AOYYFUGUUIRBML-UHFFFAOYSA-N
ID: 31704
SMILES:c1(CCCCC(OC)=O)cc(O)c2c(c1)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -16.108
InChIKey:YVMHEFAKEOWHPC-UHFFFAOYSA-N
ID: 31705
SMILES:O1c2c(c(O)cc(CCCCC)c2)C2C1(C)CCC1C(C)(C)CCCC21C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.577
CB1 binding score: -17.662
InChIKey:LVDOCXVOEIPWBZ-UHFFFAOYSA-N
ID: 31706
SMILES:CC12CN(C)C(O1)c1c(O)cc(CCCCC)cc1O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 277.364
CB1 binding score: -14.653
InChIKey:KWOUHPXADAVPFN-UHFFFAOYSA-N
ID: 31707
SMILES:c1c(O)c(C2C(C(=C)C)CCC(CO)=C2)c(O)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 276.332
CB1 binding score: -16.349
InChIKey:ZWFSNBZQRUGENI-UHFFFAOYSA-N
ID: 31708
SMILES:c1(OC)cc2c(cc1CCCCC)OC(C)(C)CCC2=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 290.403
CB1 binding score: -14.109
InChIKey:UUNMETJTPWDZAD-UHFFFAOYSA-N
ID: 31709
SMILES:c1(-c2ccc(OC)cc2CCO)cc(O)c(C2C=C(C)CCC2C(=C)C)c(O)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 394.511
CB1 binding score: -15.579
InChIKey:YGWQJUDZQWTHSX-UHFFFAOYSA-N
ID: 31710
SMILES:c1(CCC(CCOC(C)=O)C)c2c(c(O)c(C(=O)C=CC(C)C)c1)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 482.661
CB1 binding score: -16.783
InChIKey:OPWPFWZLAIKZPO-UHFFFAOYSA-N