ID: 27112
SMILES:C(CC)CCc1cc2c(c(O)c1)C1C(CCC(C)=C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 27113
SMILES:CC1(C)Oc2cc(O)c(C)c(C3C=C(C)CCC3C(=C)C)c2O1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.425
CB1 binding score: -13.437
InChIKey:XYDCIJZNAIYGMJ-UHFFFAOYSA-N
ID: 27114
SMILES:C(CC=C(C)C)C1(C)Oc2c(c(O)cc(CCCCC)c2)C(=O)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -17.376
InChIKey:AAZSXXIEAYXFSH-UHFFFAOYSA-N
ID: 27115
SMILES:CC1(O)CC2C(C(C)(C)Oc3cc(CCCCC)c(O)c(OC(=O)C)c32)C2CC(C)C(O)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 460.611
CB1 binding score: -15.035
InChIKey:DKTYZQPRFPEFGP-UHFFFAOYSA-N
ID: 27116
SMILES:c1(CCCCC)c(O)c2c3c(c1)C1(O)C(C(C)(C)O3)CC2C(c2cccc(O)c2)OC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 424.537
CB1 binding score: -17.206
InChIKey:KZBXXEORZMCLJH-UHFFFAOYSA-N
ID: 27117
SMILES:C(=C(C)CCC=C(C)C)Cc1c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.666
InChIKey:QXACEHWTBCFNSA-UHFFFAOYSA-N
ID: 27118
SMILES:CC(=CCCC(=CCc1c(O)cc(O)c2c1OC1(C)C(CCC(C)=CC1)C(C)(C)O2)C=C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 452.635
CB1 binding score: -16.267
InChIKey:XIAKNXRVTZMQRJ-UHFFFAOYSA-N
ID: 27119
SMILES:C(O)(C12Oc3c(c(CCCCC)cc(O)c3C1=O)OC(C)(C)C=C2)(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.45
CB1 binding score: -15.246
InChIKey:XFOZVXOPZNPHDC-UHFFFAOYSA-N
ID: 27120
SMILES:c1(CCCCCC)c(-c2c(O)cc(CCCCC)cc2O)c(O)c2c(c1)OC(C)(C)C1C2=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 492.7
CB1 binding score: -15.475
InChIKey:UZWISODEVSJWOY-UHFFFAOYSA-N
ID: 27121
SMILES:C1(O)CCC2(C(C)(C)Oc3c(CCCC)c(C(O)=O)cc(O)c3C2)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 348.439
CB1 binding score: -15.07
InChIKey:AGQXXTWLGVUWOF-UHFFFAOYSA-N
ID: 27122
SMILES:C1(C)(C)OC23C(C)(Oc4ccc(CCCCCC)cc42)OC2C4(OC4CC3)C(C)=CC(=O)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 452.591
CB1 binding score: -14.784
InChIKey:MBCLCOGZNQEHAV-UHFFFAOYSA-N
ID: 27123
SMILES:C1(c2c(O)cc(CCCCC)cc2O)C=C(C(C)C)CCC1=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -11.169
InChIKey:FYENRIOZJQLWSC-UHFFFAOYSA-N
ID: 27124
SMILES:C12C(OC(C)=O)C(C)(C)Oc3c(c(OC)cc(CCC)c3)C1O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 320.385
CB1 binding score: -12.69
InChIKey:BMLNPBMYSSQLCF-UHFFFAOYSA-N
ID: 27125
SMILES:Oc1c2c(c(C=O)c(CNC(C=C(C)C)=O)c1)OC(CCC=C(C)C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 451.607
CB1 binding score: -14.1
InChIKey:NSFQMCSUQGDTFW-UHFFFAOYSA-N
ID: 27126
SMILES:OCC1=CC2c3c(cc(CCCCC)cc3O)OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -19.121
InChIKey:YCBKSSAWEUDACY-UHFFFAOYSA-N
ID: 27127
SMILES:Oc1c(C(C(C)CC)=O)c2c(cc1)OC(C)(C)C1C2C=C(C)C(O)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -12.453
InChIKey:PXGGMGOQWNWLHM-UHFFFAOYSA-N
ID: 27128
SMILES:C1(C(=O)C=CC(C)=CC=O)(C)C2c3c(O)cc(C)cc3OC3(C1C(C(C)C)CC2)CC=C(C)C3=O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 476.613
CB1 binding score: -17.541
InChIKey:SQLGHQMHWOTLCH-UHFFFAOYSA-N
ID: 27129
SMILES:C1(C)(C)C2=C(c3c(O)cc(CCCCC)cc3O1)OC1(C(CO)CCC1C(C)=C)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 412.57
CB1 binding score: Not available
InChIKey:AKBPZMNUUSKUIF-UHFFFAOYSA-N
ID: 27130
SMILES:C(C(=CCc1c(O)cc(CCCCCO)cc1O)C)CC=C(C)CCC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 400.603
CB1 binding score: -16.782
InChIKey:ZKKSUUGHFOIVDB-UHFFFAOYSA-N
ID: 27131
SMILES:C=C(C)C(c1c2c(c(=O)cc(-c3ccccc3)c1O)OC(C)(C)C1CCC(C)=CC12)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 416.561
CB1 binding score: -16.08
InChIKey:ODOBZVKDPYUVBA-UHFFFAOYSA-N
ID: 27132
SMILES:C12C(c3c(cc(CCCCC)cc3O)OC1(C)C)C1C(C)(O1)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -19.791
InChIKey:VSQGBNUBIDZRPJ-UHFFFAOYSA-N