ID: 60733
SMILES:C1C(Cl)C(Cl)(C)CC(c2c(O)cc(CCCCC)cc2)C1(C)CC=CC(O)(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 441.483
CB1 binding score: -12.836
InChIKey:PKTOXUZMYHZJGK-UHFFFAOYSA-N
ID: 60734
SMILES:C(CCC)c1ccc2c(c1O)OC(C)(C)C1=C2CC(C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -20.388
InChIKey:TUMXMRLHRHOGCK-UHFFFAOYSA-N
ID: 60735
SMILES:O=C1C(OC)=C2c3c(cc(C)cc3O)OC(C)(C)C2C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.316
CB1 binding score: -12.158
InChIKey:AKENAKXLPNJVII-UHFFFAOYSA-N
ID: 60736
SMILES:C1=C(C)C2Oc3c(c(O)cc(CCCCC)c3)C3C=C(C(=O)O3)CCC1C2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 396.527
CB1 binding score: -17.392
InChIKey:ANKVFYRDKCFXJZ-UHFFFAOYSA-N
ID: 60737
SMILES:C1(C(C)C)CCC(C)=CC1c1c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.815
InChIKey:PCXRACLQFPRCBB-UHFFFAOYSA-N
ID: 60738
SMILES:C1C(C)(O)CC(c2c(O)cc(CCCC)cc2)C(C(C)C)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.474
CB1 binding score: -15.174
InChIKey:LTTQXYJBQQIPJM-UHFFFAOYSA-N
ID: 60739
SMILES:C1C(O)(C)CC2C(C(C)(C)Oc3cc(CCCCC)cc(O)c32)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -20.807
InChIKey:KSGRDIFQZVURIF-UHFFFAOYSA-N
ID: 60740
SMILES:Oc1c2c(cc(C)c1)OC(C)(C)c1C2C(O)C(CO)=CC1=O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.342
CB1 binding score: -16.144
InChIKey:CZTUBYYPIOUYDU-UHFFFAOYSA-N
ID: 60741
SMILES:C1(O)C(C(=O)O)CC2C(C)(C)Oc3cc(C)cc(O)c3C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 292.331
CB1 binding score: -14.659
InChIKey:KVGVPTGKWUEPPZ-UHFFFAOYSA-N
ID: 60742
SMILES:C1(C(=C)C)CC=C(C)CC1c1c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.129
InChIKey:ZTGXAWYVTLUPDT-UHFFFAOYSA-N
ID: 60743
SMILES:C(CCOC)c1cc(O)c2c(c1)OC(C(O)(C)C)C2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 266.337
CB1 binding score: -14.782
InChIKey:OAZTZZMERNUTOH-UHFFFAOYSA-N
ID: 60744
SMILES:c12cc(C(=O)OC)c(CCCCC)cc1OC1(C(C)(O)CCC(C(O)(C)C)O1)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 406.519
CB1 binding score: -15.055
InChIKey:GBJSUZVSJFKANC-UHFFFAOYSA-N
ID: 60745
SMILES:c1(O)cc(CCCC)cc2c1C13C(=O)OC(C)(C)C1CCC(C)(O3)C=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.462
CB1 binding score: -14.433
InChIKey:QLRZCUJGXMDESM-UHFFFAOYSA-N
ID: 60746
SMILES:c12c(c(O)cc(CCCCC)c1)C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 60747
SMILES:c1(O)cc(CCCCC)cc2c1-c1c(ccc(C)c1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 310.437
CB1 binding score: -19.554
InChIKey:VBGLYOIFKLUMQG-UHFFFAOYSA-N
ID: 60748
SMILES:Oc1cc(CCCCC)cc2c1C1C=C(CO)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -19.121
InChIKey:YCBKSSAWEUDACY-UHFFFAOYSA-N
ID: 60749
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: 60750
SMILES:C1C(C)(C)C2CC=C(C)CC2c2c1c(O)cc(CCCCC)c2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.497
CB1 binding score: -14.486
InChIKey:IGWBEWJXPBJPFG-UHFFFAOYSA-N
ID: 60751
SMILES:c1(C)c(CCCCC)cc(O)c2c1OC1(C(=O)C(C)C)CC(C)CCC1C2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.603
CB1 binding score: -16.556
InChIKey:HPLXNMKLGYRZDT-UHFFFAOYSA-N
ID: 60752
SMILES:C12C(C(C)(C)Oc3c(O)c(C(C)C(CC)OC(=O)C)cc(O)c31)CCC2=C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.477
CB1 binding score: -16.183
InChIKey:CKIDZVWMSUSKLP-UHFFFAOYSA-N
ID: 60753
SMILES:OC1(C)CC2c3c(O)cc(C)cc3OC(CCCC(C)CCCC(C)=C)(C)C2CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 414.63
CB1 binding score: -15.448
InChIKey:KOBKJEOVXVDUFC-UHFFFAOYSA-N