ID: 84904
SMILES:C(=C)(C1C(c2c(OC)cc(CCCCCC)cc2O)C(O)=C(C)C1=O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -14.112
InChIKey:UWYNQRUTVOAKSE-UHFFFAOYSA-N
ID: 84905
SMILES:CC1(C)Oc2cc(CCCCC)cc(O)c2C2C=C(C(=O)OC)CCC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -17.943
InChIKey:CCMWHLPOQSRJEP-UHFFFAOYSA-N
ID: 84906
SMILES:C(C=C(C)C)c1c(CCCCC)c2cc(C(O)=O)cc(C#CC(C)=C)c2OC1(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 406.566
CB1 binding score: -15.659
InChIKey:NUPRSKPXHQPGDW-UHFFFAOYSA-N
ID: 84907
SMILES:OC1CC2C(C)(C)Oc3c(c(O)cc(CCCCCC)c3)C2C=C1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -16.697
InChIKey:RDLUNEDCJHKYDQ-UHFFFAOYSA-N
ID: 84908
SMILES:CC1(CCC=C(C)C)Oc2c(c(O)cc(CCCCC)c2)C=C1O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -17.619
InChIKey:QQTGMMADPIRSGR-UHFFFAOYSA-N
ID: 84909
SMILES:CC1(C)C=CCC2(C)Oc3c(c(O)cc(CCCCC)c3O2)C1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -15.361
InChIKey:CENLYKLLEJVBOO-UHFFFAOYSA-N
ID: 84910
SMILES:C(CC)CCCc1cc(O)c2c(c1)OC(C)(C)C1C2CC(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.512
CB1 binding score: -18.766
InChIKey:OKXUDFJPZMVBEH-UHFFFAOYSA-N
ID: 84911
SMILES:C(CCCCCC)c1cc2c(c(O)c1)C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.523
CB1 binding score: -18.354
InChIKey:OJTMRZHYTZMJKX-UHFFFAOYSA-N
ID: 84912
SMILES:C12C(C(C)(O)C)CCC1(C)Oc1c(O)c(C(C)=O)c(CCCCC)cc1O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 376.493
CB1 binding score: -13.441
InChIKey:IFHLOAFRWGWERB-UHFFFAOYSA-N
ID: 84913
SMILES:C12C(c3c(cc(CCCCC)cc3O)OC1(C)C)CC(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -16.832
InChIKey:AFNHADXRZFCASY-UHFFFAOYSA-N
ID: 84914
SMILES:c12c(cc(CCCCC)cc1O)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 84915
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: 84916
SMILES:C(CCCC)c1cc2c(c(O)c1)C1CC(C)(O2)CCC1(O)C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -16.712
InChIKey:CQNNULQPTCZJME-UHFFFAOYSA-N
ID: 84917
SMILES:C(c1cc(O)c(CC=C(CCC=C(C)C)C)c(O)c1)(CC)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.458
CB1 binding score: -19.191
InChIKey:LMISEFHXMMRZAF-UHFFFAOYSA-N
ID: 84918
SMILES:C(C)(C1C(c2c(O)cc(CCCC)cc2O)C(O)C2(CO)OC2C1)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 348.439
CB1 binding score: -14.943
InChIKey:JEHVWSJTYNRZCS-UHFFFAOYSA-N
ID: 84919
SMILES:COc1cc2c(cc1CCCCC)OC(C)(C)C1C2CC(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.512
CB1 binding score: -15.952
InChIKey:JTNITDVJYOHCNE-UHFFFAOYSA-N
ID: 84920
SMILES:C1CC2=C(c3c1C(=O)c4c(O)c(CCC(C)C)c(O)c(CC=C(C)C)c4O)CC(C(=C)C)C1(C)C3=C(C2=O)C=CC(C)(C)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 598.78
CB1 binding score: -17.432
InChIKey:JMZQWHHCICLWDV-UHFFFAOYSA-N
ID: 84921
SMILES:C(C=C(C)CCC=C(C)C)CC1(C)Oc2cc(CCCCC)cc(OC)c2C=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 396.615
CB1 binding score: -18.505
InChIKey:HDFDVFHITGCJEG-UHFFFAOYSA-N
ID: 84922
SMILES:C1C(c2c(O)cc(CCCCC)cc2O)C(C(C)=C)CCC1(C)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -18.306
InChIKey:SCWSGMRHTABSRY-UHFFFAOYSA-N
ID: 84923
SMILES:C1=C(C)CCC(O)C(C)=CCC2C(C)(C)Oc3c(C(=O)C(C)C)c(O)cc(OC)c3C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 428.569
CB1 binding score: -16.201
InChIKey:INTWKFXEFSSQDU-UHFFFAOYSA-N
ID: 84924
SMILES:c1(O)c(C(CCCC)C(=O)C2(C)CCCC(C)(C)C2)c(O)cc(C)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.511
CB1 binding score: -10.82
InChIKey:JZJULELMTQXDJM-UHFFFAOYSA-N