ID: 92065
SMILES:C(CCCc1cc2c(c(O)c1)C1C(C2)C(CO)=CC(c2c(O)cc(CCCCC)cc2O)O1)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 466.618
CB1 binding score: -12.173
InChIKey:OYNRINBBGXBTHG-UHFFFAOYSA-N
ID: 92066
SMILES:C1(C)(C)C2CC(=O)c3c(C(=O)O)c(CCCCC)cc(O)c3C2(C)CC(=O)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.46
CB1 binding score: -12.417
InChIKey:SHXRJCACJWYXGC-UHFFFAOYSA-N
ID: 92067
SMILES:O=C1C2C(CC=C1C)C(C)(C)Oc1c2c(O)cc(CCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.398
CB1 binding score: -16.807
InChIKey:FNKHDLUJVTYPJE-UHFFFAOYSA-N
ID: 92068
SMILES:c1(CCCCC)c(C(O)=O)c(O)c2c3c1OC(C)(C)C1CCC(C)(CC31)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.477
CB1 binding score: -11.542
InChIKey:PTLVZVINZVASOB-UHFFFAOYSA-N
ID: 92069
SMILES:c12c(CCCCC)cc(O)cc1OC(C)(C)C1CC=C(C(=O)O)C=C21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.435
CB1 binding score: -16.096
InChIKey:FNYWDSLEDGJIOO-UHFFFAOYSA-N
ID: 92070
SMILES:c1(CC2C(C(CCCC(C)C)C)CCC(C)=C2)c(O)c2c(cc1C)OC(C)(C)C(O)C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 428.657
CB1 binding score: -14.776
InChIKey:XIDJMTIHGMIEBQ-UHFFFAOYSA-N
ID: 92071
SMILES:C12C(C)(C)CCCC1(C)Oc1c(c(OC)cc(CCCCC)c1)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.512
CB1 binding score: -17.738
InChIKey:DJNAMDKZRPWGEP-UHFFFAOYSA-N
ID: 92072
SMILES:OC1C(C)(C)Oc2cc(CCCCC)cc(O)c2C2CC(C)=CCC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -16.365
InChIKey:ZZENIUIHIUNPST-UHFFFAOYSA-N
ID: 92073
SMILES:C(=C(CCC=C(C)C)C)COc1cc2c(cc1O)C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 396.571
CB1 binding score: -12.234
InChIKey:KGKTXOLDMNCXBI-UHFFFAOYSA-N
ID: 92074
SMILES:O1c2c(c(O)cc(CCCCC)c2)C2CC(C)(O)CCC2C1(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -20.807
InChIKey:KSGRDIFQZVURIF-UHFFFAOYSA-N
ID: 92075
SMILES:C12c3c(O)cc(CCC)cc3OC(C)(C)C1C=CC(O)(C)C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.414
CB1 binding score: -17.379
InChIKey:CVDJYCLMBQHDGO-UHFFFAOYSA-N
ID: 92076
SMILES:C1(C)=CC(=CC(C(CCC(C)=CCc2c(O)c(C)cc(O)c2)=C)C)C=C(C)C1=O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 392.539
CB1 binding score: -15.719
InChIKey:ZOUULDSYZNUTCT-UHFFFAOYSA-N
ID: 92077
SMILES:CC1=CCCC(=C)C2C(CC1)C(C)(C)Oc1cc(CCC)cc(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 340.507
CB1 binding score: -19.615
InChIKey:UPPMRXFTGBOGTA-UHFFFAOYSA-N
ID: 92078
SMILES:C(=CCCC(=CCCC(=CCc1c(O)cc(CCCCC)c(C(O)=O)c1O)C)C)=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 440.624
CB1 binding score: -12.699
InChIKey:CLOPBLDYETZJSG-UHFFFAOYSA-N
ID: 92079
SMILES:Cc1c(CCl)c2c(c3c1OC(C)(C)CC3)OC(C)(C)C1C2C=C(C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.952
CB1 binding score: -14.309
InChIKey:ISMWQSFWSJBNBS-UHFFFAOYSA-N
ID: 92080
SMILES:C(CC)CCc1cc(O)c2c(c1)OC(C)(C)C1CC=C(C(O)=O)CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -18.707
InChIKey:OGXXAQFMAFTSRU-UHFFFAOYSA-N
ID: 92081
SMILES:Oc1c2c(cc(C)c1-c1c(O)cc(CCCCC)c(C=O)c1O)OC(C)(CCC=C(C)C)C=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 464.602
CB1 binding score: -14.023
InChIKey:KXFOQLNDNWRSSM-UHFFFAOYSA-N
ID: 92082
SMILES:CC(C1C(c2c(O)cc(CCC)cc2O)C=C(C)CC1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.431
CB1 binding score: -20.128
InChIKey:YOJPFISTURZHJT-UHFFFAOYSA-N
ID: 92083
SMILES:C1CC(C)(C(O)=O)C2(C(C)=C1)Cc1c(O)cc(CCCCC)cc1O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -13.076
InChIKey:SPLQGUVNSCBVAA-UHFFFAOYSA-N
ID: 92084
SMILES:C1(O)C(O)C(Oc2c(CC=C(C)CCC=C(C)C)c(O)cc(CCCCC)c2)OC(CO)C1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 478.626
CB1 binding score: -17.906
InChIKey:XQGPGGGCAICGJC-UHFFFAOYSA-N
ID: 92085
SMILES:c1(O)cc2c(c3c1C(CO)(C)OC(=O)CC3)C1C(C(C)(C)O2)CC=C(C)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.461
CB1 binding score: -12.995
InChIKey:DBSWDCVQFFEBDA-UHFFFAOYSA-N