ID: 130285
SMILES:C(Oc1cc(CCC)cc2c1C1C=C(C)CCC1C(C)(C)O2)c1ccc([N+](O)=O)cc1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 422.545
CB1 binding score: -13.992
InChIKey:XXNZYYQYDNVFDV-UHFFFAOYSA-N
ID: 130286
SMILES:CC(C1CCC(C)=CC1c1c(O)cc(CCCCC)cc1O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.815
InChIKey:PCXRACLQFPRCBB-UHFFFAOYSA-N
ID: 130287
SMILES:C(CCCc1cc2c(c(O)c1)C1CC(C)CCC1C(C)(C)O2)C(C)=CC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.55
CB1 binding score: -16.502
InChIKey:KQBSZLMQQIMXSI-UHFFFAOYSA-N
ID: 130288
SMILES:Oc1c(C2C(C(=C)C)CCC(C)=C2)c(OC)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -19.302
InChIKey:IPGGELGANIXRSX-UHFFFAOYSA-N
ID: 130289
SMILES:C1(C)(C)Oc2cc(CCCCC)c(C(=O)O)c(O)c2C2C1CC=C(C)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -19.507
InChIKey:YKKHSYLGQXKVMO-UHFFFAOYSA-N
ID: 130290
SMILES:C12=CC(C)CC3c4c(c(O)cc(CCCCC)c4)OC(C1(C)C)C23
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.48
CB1 binding score: -16.978
InChIKey:YXJJSKRMOQXILP-UHFFFAOYSA-N
ID: 130291
SMILES:Cc1c(C)c(C2C(C(=C)C)CCC(C)=C2)cc(O)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 256.389
CB1 binding score: -16.346
InChIKey:QSAOGIRUNVHOHX-UHFFFAOYSA-N
ID: 130292
SMILES:C1(O)C(C)=CCC2C1c1c(cc(CCCCC)cc1O)OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -19.186
InChIKey:KQQMZTULVOWZJR-UHFFFAOYSA-N
ID: 130293
SMILES:C1(CC(C)=O)C=C(C)C(CC=C(C)C)C1c1c(O)cc(CCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.506
CB1 binding score: -13.42
InChIKey:FYQHGWLAKUTJES-UHFFFAOYSA-N
ID: 130294
SMILES:C12C(CC(C)=CC1)c1c(O)cc(CCCCCCCCCC)cc1OC2=O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.533
CB1 binding score: -14.684
InChIKey:FVJWHUAHUAKCPN-UHFFFAOYSA-N
ID: 130295
SMILES:C1C(C)C(C)(C)OC2(c3c(O)cc(CCCCC)cc3OC2O)C1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 334.456
CB1 binding score: -16.35
InChIKey:PRAWVKGKBYVBRL-UHFFFAOYSA-N
ID: 130296
SMILES:C12=C(CC(C)CC1)C(C)(C)Oc1cc(CCCCC)cc(c1)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -16.472
InChIKey:VLJRMGTYIFUGSN-UHFFFAOYSA-N
ID: 130297
SMILES:C1(c2c(O)cc(CCCCC)cc2OC)CC(C)=CCC1C(=C)CCC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 396.615
CB1 binding score: -15.463
InChIKey:KZWQEIHVIKEVBH-UHFFFAOYSA-N
ID: 130298
SMILES:C1(C)=CCCC(C)=CCC2C(C)(C)Oc3c(c(O)cc(C)c3)C2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.48
CB1 binding score: -17.913
InChIKey:JHCOESLJXQEWDW-UHFFFAOYSA-N
ID: 130299
SMILES:CC1=CCC2C(C)(C)Oc3c(c(OC)cc(CCCCC)c3)C2C1OO
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -14.091
InChIKey:RNRLBWYBFIPVHJ-UHFFFAOYSA-N
ID: 130300
SMILES:c1(C(Br)(C)C)cc(O)c2c(c1)OC(C)(C)C(Br)C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 378.104
CB1 binding score: -16.102
InChIKey:LPJSQKSDHLBYQF-UHFFFAOYSA-N
ID: 130301
SMILES:c1c(CCCCC)cc(O)c(C2C=C(C)CCC2C(C)=C)c1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.427
InChIKey:QHMBSVQNZZTUGM-UHFFFAOYSA-N
ID: 130302
SMILES:C1CC(C=O)=CC2c3c(cc(CCCCC)cc3OC2(C)C)CC1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 340.507
CB1 binding score: -13.521
InChIKey:CLYSJYSTQHNULZ-UHFFFAOYSA-N
ID: 130303
SMILES:C12C(C)(C)Oc3c(c(O)cc(C)c3)C1CC(C)=CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -18.619
InChIKey:MMZAEMNNHWYQKW-UHFFFAOYSA-N
ID: 130304
SMILES:O1c2c(c(O)cc(CCCCC)c2)C2C=C(C(CC=C(C)C)O)C(=O)C(C)(C)C12O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 414.542
CB1 binding score: -15.519
InChIKey:AWAAVFZBMSUJNX-UHFFFAOYSA-N
ID: 130305
SMILES:C(C=C(C)C)CC(c1cc(O)c(C2C=C(C)CCC2C(=C)C)c(O)c1)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 354.534
CB1 binding score: -15.896
InChIKey:RQWAJHRSPXWUKN-UHFFFAOYSA-N