ID: 85030
SMILES:C(C)(=O)OC1C(C)(C)C2CCC(C)=CC2c2c(cc(CCCCC)c(C(=O)O)c2O)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 430.541
CB1 binding score: -15.006
InChIKey:RWEDVLOCMSWHSO-UHFFFAOYSA-N
ID: 85031
SMILES:C1CC(C(C)C)C(c2ccc(CCCCCCC)cc2OC)CC1C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.583
CB1 binding score: -17.754
InChIKey:NURNUBHGFXJPIW-UHFFFAOYSA-N
ID: 85032
SMILES:c12c(cccc1CO)OC(C)(C)C1C2C=C(C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -16.622
InChIKey:YFPHVWBOCQGPEF-UHFFFAOYSA-N
ID: 85033
SMILES:CCC(C(=O)c1c(O)cc(O)c2c1OC(C)(C)C1CCC(C)(O)CC21)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 362.466
CB1 binding score: -15.912
InChIKey:FVBZOAKTRQYEBD-UHFFFAOYSA-N
ID: 85034
SMILES:C1C(O)C2(C)CCC(C(=C)C)C(c3c(O)c(C(=O)O)c(CCCCC)cc3O)OC(CC=C2C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 486.649
CB1 binding score: -16.551
InChIKey:MDYVLTVQFYYKGQ-UHFFFAOYSA-N
ID: 85035
SMILES:C(C(CC(CC)C)Cc1cc(O)c(C2C(C(C)=C)CCC(C)=C2)c(O)c1)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.533
CB1 binding score: -14.228
InChIKey:OARKEGXIGLXUGF-UHFFFAOYSA-N
ID: 85036
SMILES:c1(CCCCC)cc(C2C=C(C)CC(c3cc(O)cc(C)c3)C2C2(C)OC(C)(C(O)CCC3=C(C)C(=O)C(C)=C3C)O2)cc(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 628.85
CB1 binding score: -15.052
InChIKey:HJLSETUQVGAMOS-UHFFFAOYSA-N
ID: 85037
SMILES:C12C(C)(Oc3c(C(C(C)C)=O)c(O)c(CCCCC)cc3O1)CC=C(C(C)=C)C2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.543
CB1 binding score: -15.075
InChIKey:VVVPCJLMFFUUQF-UHFFFAOYSA-N
ID: 85038
SMILES:O1c2c(c(O)cc(C)c2)C2C1C(C)(C)Oc1cc(O)cc(CCCCCC)c12
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.5
CB1 binding score: -16.281
InChIKey:CCCKJHRHKPQYSY-UHFFFAOYSA-N
ID: 85039
SMILES:C(C)(=CCC1C(C)(C)C2(C(=O)OC)C(CC(C)=CC2c2c(O)cc(CCCC)cc2O)O1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 456.623
CB1 binding score: -15.116
InChIKey:HQFQJGODVURAAJ-UHFFFAOYSA-N
ID: 85040
SMILES:C(=CC1=CC(O)C2c3c(O)cc(CCCCC)cc3OC2(C)CC=C1CC=C(C)C)CCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 464.69
CB1 binding score: -14.932
InChIKey:RSFLUUMLGZYWNE-UHFFFAOYSA-N
ID: 85041
SMILES:Cc1c(-c2cc(C(C)C)c(OI)cc2C)c(O)c2c(c1)OC(C)(C)C1CCC(=C)CC21
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 532.462
CB1 binding score: -15.817
InChIKey:OGRJZUAAKGKMTD-UHFFFAOYSA-N
ID: 85042
SMILES:O1c2c(c(O)cc(CCC)c2)C2CC(C)CCC2C1(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.431
CB1 binding score: -18.987
InChIKey:QYNCMPYNYFYQFE-UHFFFAOYSA-N
ID: 85043
SMILES:c1(O)cc2c(cc1CCCCC)OC1(C)C(CC3C(C)(O3)CC=C1C(C)C)OC2=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 414.542
CB1 binding score: -12.615
InChIKey:PYAUTNDJDBNBLX-UHFFFAOYSA-N
ID: 85044
SMILES:C(C=C(C)C)CC1(C)Oc2cc(CCCCC)cc(O)c2C=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.933
InChIKey:UVOLYTDXHDXWJU-UHFFFAOYSA-N
ID: 85045
SMILES:C(CCc1cc2c(c(O)c1)C1C(C(C)(C)O2)CCC(C)=C1)CCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -19.964
InChIKey:DMJVNNFBMZZLFB-UHFFFAOYSA-N
ID: 85046
SMILES:CC1(C)C2CCC(C)=CC2c2c(O)cc(CCCCCO)cc2O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -17.915
InChIKey:LNEDOGQBWSHVNR-UHFFFAOYSA-N
ID: 85047
SMILES:C=C(CCC1(C)C(C(=O)OC)=CCCC2C1C(c1c(OC)cc(CCCCC)cc1O)O2)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 456.623
CB1 binding score: -14.932
InChIKey:LGGLYTMZXMDNDD-UHFFFAOYSA-N
ID: 85048
SMILES:C1CC(CCCCC)C(Cc2cc(CC=C(C)C)ccc2O)C(C(=C)C)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 368.605
CB1 binding score: -16.405
InChIKey:GVABNCXEYQAQBT-UHFFFAOYSA-N
ID: 85049
SMILES:C1(C)(C)Oc2cc(CCCCC)c(C(=O)O)c(O)c2C2C=C(C)CCC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -19.351
InChIKey:UCONUSSAWGCZMV-UHFFFAOYSA-N
ID: 85050
SMILES:c1c(CCCCC)cc(O)c(CC=C(C)CCC2C(=C)C(C)CCC2=C)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids;Diterpenoids
Class: Cannabinoids;Cyclophytane diterpenoids
MW: 366.589
CB1 binding score: -15.929
InChIKey:FJWTXAZUGDVKNX-UHFFFAOYSA-N