ID: 109054
SMILES:COc1c(OC)cc2c(c1)OC(C)(C)C1C2C=C(C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.387
CB1 binding score: -19.512
InChIKey:XSVIAZSLVNZZSQ-UHFFFAOYSA-N
ID: 109055
SMILES:C1(C)C2C(Oc3cc(CCCCC)cc(O)c32)C(C(C)(O)C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -14.815
InChIKey:CNTNPOWKIZYCKW-UHFFFAOYSA-N
ID: 109056
SMILES:C(CCCCC)c1c(O)c2c(c(O)c1)C1C(CC=C(C)C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -17.327
InChIKey:KCHDGNWQYWLSBR-UHFFFAOYSA-N
ID: 109057
SMILES:Oc1c(CC(C)O)cc(O)c(C2C=C(C)CCC2C(C)=C)c1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.413
CB1 binding score: -15.3
InChIKey:LAJOTFSODWCLOG-UHFFFAOYSA-N
ID: 109058
SMILES:C1C(C)=CC(c2c(O)cc(CCCCC)cc2O)C(C(C)=C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.427
InChIKey:QHMBSVQNZZTUGM-UHFFFAOYSA-N
ID: 109059
SMILES:C(CC)CCc1cc2c(c(O)c1)C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 109060
SMILES:CC1(C)C(c2c(O)cc(CCCCC)cc2O)(C)CCC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 290.447
CB1 binding score: -17.453
InChIKey:NIVAQGHPRXHFPI-UHFFFAOYSA-N
ID: 109061
SMILES:C#CCCc1cc(O)c(C2C(C(C)(O)C)CCC(C)=C2)c(O)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.425
CB1 binding score: -13.472
InChIKey:FLZUNHZYQTZTCR-UHFFFAOYSA-N
ID: 109062
SMILES:C1(C)=CC(c2c(O)cc(CCCCC)cc2O)C(C(C)C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.815
InChIKey:PCXRACLQFPRCBB-UHFFFAOYSA-N
ID: 109063
SMILES:c12c3c(cc(C)c1C(=O)C=C(C)C2O)-c1c(O)cc(CCCCC)cc1OC3(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 406.522
CB1 binding score: -15.748
InChIKey:YFNGRYPFFZBREW-UHFFFAOYSA-N
ID: 109064
SMILES:c1(O)c2c(cc(CCCCC)c1)OC(C)(C)C1C2CC(C(OC)=O)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -18.703
InChIKey:ODGYRHKHFGCIRR-UHFFFAOYSA-N
ID: 109065
SMILES:c1(CC(C2CC=C(C)CC2)OC(=O)C)c(O)cc(CCCCC)cc1OC(=O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 402.531
CB1 binding score: -15.084
InChIKey:ACASRYDGPRPWEY-UHFFFAOYSA-N
ID: 109066
SMILES:C1(C)=CCC2C(C1)c1c(O)cc(CCCCC)cc1OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 109067
SMILES:CC1=CC(c2ccc(CCCC)oc2=O)C(C(=C)C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -12.688
InChIKey:KZUMEAKGKYHGOV-UHFFFAOYSA-N
ID: 109068
SMILES:c1(O)c(O)cc(C)c2c1C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.36
CB1 binding score: -17.35
InChIKey:BLLJMAJZGLTZJU-UHFFFAOYSA-N
ID: 109069
SMILES:C(Cc1cc(O)c(C2C(O)C(C)=CCC2C(=C)C)c(O)c1)C(CC(C)C)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.505
CB1 binding score: -15.434
InChIKey:KXFZCHLQWBWJNR-UHFFFAOYSA-N
ID: 109070
SMILES:C(CCCC1(C)C=Cc2c(cc(C)cc2O)O1)C(C)CCCO
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.457
CB1 binding score: -16.015
InChIKey:RYWXFNOVVGWVHA-UHFFFAOYSA-N
ID: 109071
SMILES:C(=C(C)CC(C=C(C)C)=O)Cc1c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 330.468
CB1 binding score: -17.947
InChIKey:ZXDVFJZNEMZQLZ-UHFFFAOYSA-N
ID: 109072
SMILES:C1CC(C(C)=C)C(c2c(O)cc(CCCCC)cc2O)C=C1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.427
InChIKey:QHMBSVQNZZTUGM-UHFFFAOYSA-N
ID: 109073
SMILES:C(C=C(C)C)c1c(O)cc(CCCCC)cc1O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 248.366
CB1 binding score: -20.5
InChIKey:YVUPWYODRDEDFU-UHFFFAOYSA-N
ID: 109074
SMILES:C12Oc3cc(C)cc(O)c3C1CCC(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 234.295
CB1 binding score: -14.995
InChIKey:UDEPCZNELYYJFY-UHFFFAOYSA-N