ID: 93031
SMILES:O1C(=O)C2=CC1C(CC=O)(C)C1c3c(O)cc(CCCCC)cc3OC(C)(C)C1C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 412.526
CB1 binding score: -15.848
InChIKey:JLZANWLNVJMPRI-UHFFFAOYSA-N
ID: 93032
SMILES:c12c(cc(CCCC(O)=O)cc1O)C=CC(CCC=C(C)C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.424
CB1 binding score: -15.73
InChIKey:DVUPCGLXLUTQRH-UHFFFAOYSA-N
ID: 93033
SMILES:C1(C)=CC2C(CC1)C(C)(C)Oc1c2c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 93034
SMILES:C(CCCC)c1cc(O)c(C2C=C(C)CCC2C(=C)C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.427
InChIKey:QHMBSVQNZZTUGM-UHFFFAOYSA-N
ID: 93035
SMILES:C1CC(C)C2(Oc3c(cc(CCCCC)cc3O)C2)C2C1C(CCC=C(C)C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 412.614
CB1 binding score: -15.381
InChIKey:QRSLJYGQUZUGEJ-UHFFFAOYSA-N
ID: 93036
SMILES:C(=O)(CCCC)c1ccc(O)c2c1OC(C)(C)C1CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -15.715
InChIKey:FIXQMGUMNAMDSY-UHFFFAOYSA-N
ID: 93037
SMILES:C1(C)C(=O)OC(c2c(O)cc(CCCCC)cc2O)C1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 278.348
CB1 binding score: -16.541
InChIKey:LWKZWFDVTUEPKE-UHFFFAOYSA-N
ID: 93038
SMILES:c1c(CCCCC)cc2c(c1O)C1C(C(=C)CO)(CCC(CO)C1)O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -16.341
InChIKey:FWRVVIGFJDYQRD-UHFFFAOYSA-N
ID: 93039
SMILES:C12=CC(=C)CCC1C(C)(C)Oc1cc(CCCCC)cc(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.453
CB1 binding score: -18.44
InChIKey:KJWARAZFZUTBKD-UHFFFAOYSA-N
ID: 93040
SMILES:C(Cc1cc2c(c(O)c1)C1CC(C)CCC1(O)O2)=C(C)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.387
CB1 binding score: -16.317
InChIKey:BBEUDSPZELPXCN-UHFFFAOYSA-N
ID: 93041
SMILES:C1(CCCO)Oc2c(c(O)cc(C)c2)C=C1C(CCCC(C)CC)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.511
CB1 binding score: -12.417
InChIKey:BUFBTAKUHAZWBZ-UHFFFAOYSA-N
ID: 93042
SMILES:C1CC2(C)Oc3c(c(O)cc(CCCCC)c3)C2C2C1C(C)(O)CCC2C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.603
CB1 binding score: -15.929
InChIKey:SFMKJNAWUKLGFL-UHFFFAOYSA-N
ID: 93043
SMILES:C1C(C)(C)Oc2c(c(O)cc(CCCCC)c2)C2C=C(C(O)=O)CCC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -15.371
InChIKey:VCECSUODLPHEHD-UHFFFAOYSA-N
ID: 93044
SMILES:O1c2c(c(O)cc(CCCCC)c2)C2C=C(C(=O)OC)CCC2C1(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -17.943
InChIKey:CCMWHLPOQSRJEP-UHFFFAOYSA-N
ID: 93045
SMILES:CC1=CC2Oc3c(c(O)cc(CCCCC)c3)C2C2(C)CCC(O)C(CCC=C(C)C)(C)C2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 466.706
CB1 binding score: -14.995
InChIKey:YFULKDFRCXPUQF-UHFFFAOYSA-N
ID: 93046
SMILES:CC1(C)C2CCC(C)=CC2c2c(O)cc(C=Cc3cc(O)c(O)c(CC=C(C)CCC=C(C)C)c3)cc2O1
Pathway: Shikimates and Phenylpropanoids;Terpenoids
Superclass: Meroterpenoids;Stilbenoids
Class: Cannabinoids;Monomeric stilbenes
MW: 514.706
CB1 binding score: -18.149
InChIKey:JLXKYDASRGFBJU-UHFFFAOYSA-N
ID: 93047
SMILES:c1(C(C)=O)c(=O)c2c(cc(O)c1CC=C(CCC=C(C)C)C)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 450.619
CB1 binding score: -15.62
InChIKey:SURPWWBZNUHYSY-UHFFFAOYSA-N
ID: 93048
SMILES:C(CCCC)Cc1cc2c(c(O)c1)C1C=C(C(=O)OC)C3CC(C3)C1(C)C(=O)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.499
CB1 binding score: -15.359
InChIKey:PMNDVSSOSHCEAT-UHFFFAOYSA-N
ID: 93049
SMILES:Oc1c2c(c(CCCC)cc1O)OC(C)(C)C1CC(O)C(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.44
CB1 binding score: -12.08
InChIKey:BJXSOVSVDZWECH-UHFFFAOYSA-N
ID: 93050
SMILES:CC(CCC1C2Cc3c(O)cc(C)cc3OC2(C)CC=C1C(C)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.523
CB1 binding score: -17.527
InChIKey:DPLLEHJQBHNVDW-UHFFFAOYSA-N
ID: 93051
SMILES:C1(C)(CCC=C(C)C)Oc2c(c(O)cc(CCCCC)c2)C2C1O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -16.828
InChIKey:VWVYPBSOQKGBDL-UHFFFAOYSA-N