ID: 59956
SMILES:CC1(O)C(O)C2C(C(C)(C)Oc3cc(CCCCC)c(O)c(O)c32)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 364.482
CB1 binding score: -15.294
InChIKey:NJGIRNAYLRRFPS-UHFFFAOYSA-N
ID: 59957
SMILES:C(=CCCC1(C)Oc2cc(CCCCC)c(C(=O)OC)c(O)c2C=C1)C(=C)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.516
CB1 binding score: -15.612
InChIKey:ZHELFVOZVJCXHP-UHFFFAOYSA-N
ID: 59958
SMILES:C1=C(C)C2(Oc3c(c(O)cc(CCCCC)c3)C2)C(C)(C)C(O)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -15.188
InChIKey:VPPYVRSDKAPKLT-UHFFFAOYSA-N
ID: 59959
SMILES:CCCCCc1ccc(O)c2c1OC(C)(C)C1CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -18.367
InChIKey:ARCCJNTVTZPGNU-UHFFFAOYSA-N
ID: 59960
SMILES:C12C(c3c(O)cc(CCCCC)cc3O1)C(C(C)C)CCC2C(=O)CCc1ccc(O)cc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 450.619
CB1 binding score: -15.62
InChIKey:LTRAFJAIRDSLDH-UHFFFAOYSA-N
ID: 59961
SMILES:O1c2c(c(O)cc(CCCC)c2)CC2(C)CCCC(C)=C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -15.634
InChIKey:PVHYVMBTMVENFP-UHFFFAOYSA-N
ID: 59962
SMILES:C1C2(C)C3(Oc4c3c(O)cc(CCCCC)c4)C(=C(C)C1)CC(C(C)=C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 380.572
CB1 binding score: -15.507
InChIKey:YVRLULNEBMGTEF-UHFFFAOYSA-N
ID: 59963
SMILES:C(C)(=O)OCC1=CC2c3c(cc(CCCCC)cc3O)OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.505
CB1 binding score: -19.773
InChIKey:ILHSUWMZKIAMCQ-UHFFFAOYSA-N
ID: 59964
SMILES:C(CCC)Cc1cc(O)c(C(=O)CC(C)C)c2c1OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.587
CB1 binding score: -15.476
InChIKey:VBQBZNPKDDRFAX-UHFFFAOYSA-N
ID: 59965
SMILES:C1(C)CCC2C(C)(C)Oc3cc(C)c(C(=O)OC)c(O)c3C21
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.386
CB1 binding score: -16.022
InChIKey:GPLNEJUOJUPQNK-UHFFFAOYSA-N
ID: 59966
SMILES:c1c(CCCCC)cc2c(c1O)C1C(C(=C)C)CCC1(C)CC2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.497
CB1 binding score: -17.596
InChIKey:RWFIRVYASWVANS-UHFFFAOYSA-N
ID: 59967
SMILES:c1(CCCCC)cc(O)c2c(c1)OC(C)(C)C1=C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.453
CB1 binding score: -20.728
InChIKey:RECLSNODOVFMMU-UHFFFAOYSA-N
ID: 59968
SMILES:Oc1c2c(c(CCCCC)cc1O)OC(C)(CCC=C(C)C)C(O)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 348.483
CB1 binding score: -16.513
InChIKey:XREVQHWOQIKNIR-UHFFFAOYSA-N
ID: 59969
SMILES:CC1(C)C(C)(Cl)Cc2c(O)cc3c(c21)OC(C)(C)C1CCC(C)=CC31
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.925
CB1 binding score: -15.65
InChIKey:IHFYVVRJWQNGBP-UHFFFAOYSA-N
ID: 59970
SMILES:CC(C)=CC1CC(C)C2c3c(c(C(O)=O)c(CCCCC)cc3O)OC(C)(C)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.559
CB1 binding score: -15.013
InChIKey:CTYQSLQZROODFS-UHFFFAOYSA-N
ID: 59971
SMILES:O=C(OCC1(c2c(OC)cc(CCCCC)cc2OC(C(C)C)=O)CCCC1O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 420.546
CB1 binding score: -16.391
InChIKey:GZDHPNQDIRBKPJ-UHFFFAOYSA-N
ID: 59972
SMILES:C(CCc1cc2c(c(O)c1)C1C(C(=C)C)CCC(C)(CCC2)O1)c1ccccc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 390.567
CB1 binding score: -15.712
InChIKey:QTNLZIOHADNSHM-UHFFFAOYSA-N
ID: 59973
SMILES:C(CC)Cc1cc2c(c(O)c1)C1C=C(C)CCC1C(C)(O)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -16.262
InChIKey:UVYLYEJNINOWBM-UHFFFAOYSA-N
ID: 59974
SMILES:CC(C1C(c2c(O)cc(CCCCC)cc2O)C=C(C)CC1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.815
InChIKey:PCXRACLQFPRCBB-UHFFFAOYSA-N
ID: 59975
SMILES:c1c2c(cc(CCCCC)c1)OC(C(C)(C)O)C2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 248.366
CB1 binding score: -18.316
InChIKey:GOOVIKRDBAWBMD-UHFFFAOYSA-N
ID: 59976
SMILES:C1(O)C(C)=CCC2c3c(cc(CCCCC)cc3O)OC(C)(C)C21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -16.546
InChIKey:BBIHENVVOQODBF-UHFFFAOYSA-N