ID: 34945
SMILES:C(CCC)c1cc2c(c(O)c1)C1CC(C(OC)=O)=CCC1C(=C)C=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 338.447
CB1 binding score: -14.647
InChIKey:QOLXMEFGLMCJCF-UHFFFAOYSA-N
ID: 34946
SMILES:C(C)CCCc1cc(O)c2c(c1)OC(C)(C)C1CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 34947
SMILES:C1(C)(C)Oc2c(c(O)cc(CCCCC)c2)C2C1CCC(COC)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -17.881
InChIKey:PQZMQHVIZFPKQU-UHFFFAOYSA-N
ID: 34948
SMILES:CCC(=O)C1C(CCCC(C)=O)(C)CC(c2c(O)cc(CCCC)cc2O)O1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 390.52
CB1 binding score: -15.349
InChIKey:ALGRSXPUYREMFD-UHFFFAOYSA-N
ID: 34949
SMILES:OC(=O)CCc1cc(O)c(CC=C(CCC=C(C)C)C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 318.413
CB1 binding score: -18.016
InChIKey:OVJKPQKAIHSVBC-UHFFFAOYSA-N
ID: 34950
SMILES:C1=CC(C)CC2C1C(C)(C)Oc1c2c(O)cc(C)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -17.269
InChIKey:UJUOIUNDVOQUOS-UHFFFAOYSA-N
ID: 34951
SMILES:c1c2c(ccc1CCCCC)cc(OC1CC(C)(CCC=C(C)C)OC1(C)C)c(=O)cc2O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 452.635
CB1 binding score: -15.25
InChIKey:FWGWCFZTIRJWRR-UHFFFAOYSA-N
ID: 34952
SMILES:C(CCC)Cc1cc(O)c2c(c1)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: 34953
SMILES:c1(CCCCCC)cc2c(c(O)c1)C1C(CC(O)C(C)(C)O1)C(=O)O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 348.439
CB1 binding score: -14.605
InChIKey:DRNVRUQCBPTYTI-UHFFFAOYSA-N
ID: 34954
SMILES:C1C2CCC(C)(OC2(C)C)C(c2c(O)cc(CCCCC)cc2O)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 348.483
CB1 binding score: -14.084
InChIKey:YVKIFLFPERUZEG-UHFFFAOYSA-N
ID: 34955
SMILES:c1(Oc2c(C(C)C)ccc(C)c2O)c(CCCCCC)cc2c(c1O)C1C(CCC(CO)=C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 508.699
CB1 binding score: -14.718
InChIKey:AVHIMZNCPDTNMT-UHFFFAOYSA-N
ID: 34956
SMILES:C12C(C)(Oc3cc(CCC)cc(O)c31)C1OC(C(O)(C)C)CCC(C)(C2)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.521
CB1 binding score: -14.951
InChIKey:KGGRHMXYIXWQIE-UHFFFAOYSA-N
ID: 34957
SMILES:CC1=CC2c3c(cc(C)c(O)c3)OC(C)(C)C2C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Miscellaneous meroterpenoids
MW: 244.334
CB1 binding score: -16.767
InChIKey:ZQEYFSGPWCAWNS-UHFFFAOYSA-N
ID: 34958
SMILES:C(Cc1cc2c(c(O)c1)C1C(C(O)(C)CCC(O)C(C)(C)O2)CCC(C)(C)O1)C=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 446.628
CB1 binding score: -12.948
InChIKey:GZUWGRHQNNDGCL-UHFFFAOYSA-N
ID: 34959
SMILES:C(CCO)Oc1c2c(cc(CCCCC)c1)OC(C)(C)C1C2CC(C)(O)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 390.564
CB1 binding score: -15.713
InChIKey:VBJPSNUVUBZYMT-UHFFFAOYSA-N
ID: 34960
SMILES:Oc1c(C(CC(=O)O)c2cc(CCC(=O)C(C)=C)cc(O)c2O)cc(O)c(CC=C(C)CCC=C(C)C)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 522.638
CB1 binding score: -13.892
InChIKey:OIJICAFTPIDJPH-UHFFFAOYSA-N
ID: 34961
SMILES:C(C1=CC2C(C(C)(C)Oc3cc(O)cc(CCCCC)c32)CC1)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -16.438
InChIKey:YEYMUUHPLQKPFV-UHFFFAOYSA-N
ID: 34962
SMILES:C12C(C)(C)Oc3cc(CCCC)cc(O)c3C1CC(C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.458
CB1 binding score: -19.792
InChIKey:UGRLMQVLYLFVDE-UHFFFAOYSA-N
ID: 34963
SMILES:C12CC3c4c(c5c(cc(CCCCC)cc5)OC#CC(CC1)C(C)(C)O4)OC2C=C(C)CCC=C(C)CC3
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 514.75
CB1 binding score: -16.739
InChIKey:UBFJTXXBDFTWMD-UHFFFAOYSA-N
ID: 34964
SMILES:CC1=CCC2C(C1)c1c(O)cc(C)cc1OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -18.619
InChIKey:MMZAEMNNHWYQKW-UHFFFAOYSA-N
ID: 34965
SMILES:C12(C(C)(C)C(O)CC(OC(C)=O)C1(O)C)Cc1cc(CCCCC)cc(O)c1O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 406.519
CB1 binding score: -15.303
InChIKey:BGVJJPUYMLWLOE-UHFFFAOYSA-N