ID: 111889
SMILES:CC(C)C1C(c2c(O)cc(CCC)cc2O)C=C(CO)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.43
CB1 binding score: -16.987
InChIKey:RVSDLGGWUBIOAS-UHFFFAOYSA-N
ID: 111890
SMILES:c1(O)cc2c(c(O)c1)C1CC(C)=CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 260.333
CB1 binding score: -18.561
InChIKey:RRHAEGQFRQNVHT-UHFFFAOYSA-N
ID: 111891
SMILES:c1c(CCCCC)cc2c(c1)OC(C)(C)C1CC=C(C)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.47
CB1 binding score: -17.649
InChIKey:CBFJCKSFJPWQQA-UHFFFAOYSA-N
ID: 111892
SMILES:CC1=CCC(C(C)C)C(Cc2c(O)cc(CCCCC)cc2OC)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.539
CB1 binding score: -15.873
InChIKey:RRCARZNOWKNGBI-UHFFFAOYSA-N
ID: 111893
SMILES:c1(CCCC(O)C)cc(OC)c(O)c2c1OC(C)(CCC=C(C)C)C=C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -13.948
InChIKey:PFUMEQRILHXHOJ-UHFFFAOYSA-N
ID: 111894
SMILES:c1(O)c(OCC)cc(C=O)cc1C1C=C(C)CCC1C(=C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.398
CB1 binding score: -13.522
InChIKey:IRPJWWIVZAVWKR-UHFFFAOYSA-N
ID: 111895
SMILES:CC1CCC(C(=C)C)C(c2c(O)cc(CCC)cc2O)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.431
CB1 binding score: -19.57
InChIKey:LURPWARMGYBTPS-UHFFFAOYSA-N
ID: 111896
SMILES:C(C(C)=CCCC(C)=CCc1c(O)cc(CCCCC)cc1O)C(O)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -13.581
InChIKey:JRIYMJLQIHCGAT-UHFFFAOYSA-N
ID: 111897
SMILES:C1(C)=CCC2C1c1c(c(O)c(OC)cc1CCCCC)OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -13.564
InChIKey:WQZVJYYYRSYFLC-UHFFFAOYSA-N
ID: 111898
SMILES:C1(C(C)(C)OC(=O)C)CCC(C)=CC1c1c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.521
CB1 binding score: -17.957
InChIKey:MMOUECRGOJAVPX-UHFFFAOYSA-N
ID: 111899
SMILES:C1(C)(C)Oc2c(c(O)cc(C(C3C(CCC(C)=O)C(=O)CC(C)=CC(O)C=C(C)C)C3)c2O)C2OC(=O)C(C)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 554.68
CB1 binding score: -15.188
InChIKey:WERVAWUWAVAXMH-UHFFFAOYSA-N
ID: 111900
SMILES:C12=CC(C(C)(O)C)CCC1(C)Oc1cc(CCCCC)cc(OC)c1C2C=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 412.614
CB1 binding score: -15.374
InChIKey:WSRYFUFKECOCFS-UHFFFAOYSA-N
ID: 111901
SMILES:C(CCc1cccc(O)c1)(C)CCCc1cc(OC)c(C2C(C(C)=C)CCC(C)=C2)cc1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 432.648
CB1 binding score: -14.47
InChIKey:CQCQVXOKRVHMMF-UHFFFAOYSA-N
ID: 111902
SMILES:c1(CCCCC)cc2c(c(O)c1)C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 111903
SMILES:C(CCc1cc2c(c(O)c1)C1CC(=C(C)C)C(=O)CC1(C)O2)CCCCCCCC=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 424.625
CB1 binding score: -15.316
InChIKey:CMOIOMJXNNZZFS-UHFFFAOYSA-N
ID: 111904
SMILES:Oc1cc2c(c(OC)c1)C1CC(=C)CCC1C(C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.36
CB1 binding score: -15.818
InChIKey:VJOFYHQBFFXBCF-UHFFFAOYSA-N
ID: 111905
SMILES:CC(CCC(C(C)(O)C)O)=CCCC(=O)C1CCC2(C)Oc3cc(CCCCC)cc(O)c3C21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 472.666
CB1 binding score: -13.522
InChIKey:KQMOEPCNPFVBGX-UHFFFAOYSA-N
ID: 111906
SMILES:Oc1c(CC=C(C)C)c(O)cc(CCCCC)c1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 248.366
CB1 binding score: -20.5
InChIKey:YVUPWYODRDEDFU-UHFFFAOYSA-N
ID: 111907
SMILES:Oc1c(C2C(C(=C)C)CCC(C)=C2)c(O)cc(CCc2ccc(O)c(O)c2)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 380.484
CB1 binding score: -18.486
InChIKey:FDFDTELOCMXKRH-UHFFFAOYSA-N
ID: 111908
SMILES:Oc1cc(CCCCC)cc2c1C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 111909
SMILES:c1(CCCCC)cc2c(c(O)c1)C1=C(C(C)(C)O2)CCC(C)(O)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -18.269
InChIKey:SEZYEGYUECNXNK-UHFFFAOYSA-N