ID: 98995
SMILES:C(C)CCc1cc(O)c(CC=C(C)CCC=C(C)C=O)c2c1OC(C(O)(C)CCC=C(C)C)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 468.678
CB1 binding score: -14.006
InChIKey:UPTVWIZZDGSKHZ-UHFFFAOYSA-N
ID: 98996
SMILES:c1(O)cc(CCCCC)c(C(=O)O)c(O)c1CC=C(C)CCC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -19.234
InChIKey:SEEZIOZEUUMJME-UHFFFAOYSA-N
ID: 98997
SMILES:C(C1=CCC2(C(C)(C)O2)C(O)C1)CCC(=CCc1c(O)ccc(O)c1)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -14.953
InChIKey:ZLGVDZPGQPQEAH-UHFFFAOYSA-N
ID: 98998
SMILES:c1(CCCCC)cc(O)c2c(c1)OC(C)(C)C1CC=C(C)C(O)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -19.186
InChIKey:KQQMZTULVOWZJR-UHFFFAOYSA-N
ID: 98999
SMILES:C1(C)C(C)(C)C(C)(c2c(OC)cc(CCCCC)cc2O)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.501
CB1 binding score: Not available
InChIKey:DLYDPIAKMGLKHN-UHFFFAOYSA-N
ID: 99000
SMILES:Oc1cc(OC)c2c(c1)C1C=C(C)CCC1C(C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.36
CB1 binding score: -17.662
InChIKey:MTJFYDONBDGRHM-UHFFFAOYSA-N
ID: 99001
SMILES:C(CC)Cc1c(C(=O)O)c(O)c(CC=C(C)CCC=C(C)C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -18.957
InChIKey:BBTJGOMWXQQCKF-UHFFFAOYSA-N
ID: 99002
SMILES:CC1(C)CCCC2(C)Oc3c(c(O)cc(CCC)c3)C21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.404
CB1 binding score: -18.382
InChIKey:NWBNUQVDZQYLEV-UHFFFAOYSA-N
ID: 99003
SMILES:OC1CC2=C(c3c(cc(CCCCC)cc3O)OC2(C)C)C=C1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -17.866
InChIKey:NZLHNXGSLRBQPW-UHFFFAOYSA-N
ID: 99004
SMILES:O(C)c1cc2c(cc1)OC(C)(C)C1CC=C(C)CC12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -17.764
InChIKey:NRRZXOLZVDIGDT-UHFFFAOYSA-N
ID: 99005
SMILES:CC(=CCCC(C)=CCC(CC(=O)c1cc(O)c(C2C=C(C)CCC2C(C)C)c(O)c1)C(C)C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 480.733
CB1 binding score: -14.575
InChIKey:SGCKJZFYZRRGML-UHFFFAOYSA-N
ID: 99006
SMILES:C1C(C)=C2C(C)(C=C3C(C(C)(C)Oc4c3c(O)cc(CCCCC)c2)C4)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 380.572
CB1 binding score: -14.195
InChIKey:QVIWIOZEQKBLHS-UHFFFAOYSA-N
ID: 99007
SMILES:C(CCCC)Cc1cc2c(cc1)OC(C)(C)C1CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.497
CB1 binding score: -17.133
InChIKey:ZHIBKDCGILZWOW-UHFFFAOYSA-N
ID: 99008
SMILES:CC(CCC=C(C)C)=CCc1c(O)cc(CCCCC)c(C(=O)OCCC)c1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 402.575
CB1 binding score: -15.364
InChIKey:QJHLRBVPBANMGG-UHFFFAOYSA-N
ID: 99009
SMILES:C(CCCO)c1cc(O)c2c(c1)OC(C)(C)C1CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -16.759
InChIKey:NIRSQPIJCAWYGX-UHFFFAOYSA-N
ID: 99010
SMILES:C(=N)(NC)NC1C(C(C)=C)C(c2c(O)cc(CCCCCO)cc2O)C=C(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 401.551
CB1 binding score: -13.39
InChIKey:QLLUXJQXIGALMW-UHFFFAOYSA-N
ID: 99011
SMILES:C1C2(C)CC3c4c(cc(CCCCC)cc4OC3(C)C)C=C(C)CC2CC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 392.627
CB1 binding score: -12.121
InChIKey:PZYCOQLPNKDGTK-UHFFFAOYSA-N
ID: 99012
SMILES:C1C2C(CCC=C(C)C)(C)C(O)C(c3c(cc(CCCCC)cc3O)O2)C(C)(C)C1=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 428.613
CB1 binding score: -14.578
InChIKey:OQHRXMSDEBEBRA-UHFFFAOYSA-N
ID: 99013
SMILES:C(C1(C)CC(c2c(O)cc(CCCCC)cc2O)C=C(C)CC1)Cl
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 350.93
CB1 binding score: -13.068
InChIKey:VGHJJWCJRLVLPW-UHFFFAOYSA-N
ID: 99014
SMILES:c12c(ccc(O)c1)OC(C)(C)C1C2CC(C)(O)C2OC12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 276.332
CB1 binding score: -14.242
InChIKey:KJJRBLRJSWBCMB-UHFFFAOYSA-N
ID: 99015
SMILES:c1(CCCCC)cc(O)c(C2C(C(=C)C)CCC(C)(O)C2)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -18.306
InChIKey:SCWSGMRHTABSRY-UHFFFAOYSA-N