ID: 52522
SMILES:C(CCC)Cc1cc(O)c2c(c1)C(=O)CC(CO)(C)O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 278.348
CB1 binding score: -13.547
InChIKey:OULBOQNNNYIUSH-UHFFFAOYSA-N
ID: 52523
SMILES:c1c(CCCCC)cc(O)cc1Oc1c(CC=C(C)C)c(O)c2c(c1C)OC(C)(C)C1CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 504.711
CB1 binding score: -14.184
InChIKey:CMUWRCABUSYVGQ-UHFFFAOYSA-N
ID: 52524
SMILES:C(CCCc1cc(OC)c2c(c1)OC(C)(C)C1CCC(C=O)=CC21)CCCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.587
CB1 binding score: -16.086
InChIKey:WWPABICRFIJNCA-UHFFFAOYSA-N
ID: 52525
SMILES:COc1c2c(ccc1-c1c3c(cc(O)c1)OC(C)(C)C(O)C3)OC(C)(C)C1C3CC(C)=CC1C3C2OCC=C(CO)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 576.73
CB1 binding score: -12.705
InChIKey:CNIDBZWBXLYJMF-UHFFFAOYSA-N
ID: 52526
SMILES:C(O)CCc1cc(O)c(CC=C(C)CCC=C(CCC=C(C)C)C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 372.549
CB1 binding score: -17.11
InChIKey:YFBDFUDGLUYOJH-UHFFFAOYSA-N
ID: 52527
SMILES:c1(CCCCC)cc2c(c(O)c1C=O)OC1(C)C(C)C=C(C)CCC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -15.005
InChIKey:IQYPDXBPWQKBBT-UHFFFAOYSA-N
ID: 52528
SMILES:C1(=O)C=C(C)CC2c3c(OC)cc(C)cc3OC(C)(C)C12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.371
CB1 binding score: -14.041
InChIKey:DBTLLXZAIVZYAT-UHFFFAOYSA-N
ID: 52529
SMILES:Cc1cc(OC)c(O)c2c1CC(C(=C)C)C(CC1C(C)(C)O1)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.413
CB1 binding score: Not available
InChIKey:LFAFYKWHIMHLRC-UHFFFAOYSA-N
ID: 52530
SMILES:C1C2C(C(C)(C)Oc3cc(CCC)cc(O)c32)C2C(C)(O1)C1C(O2)C2OC2(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 414.542
CB1 binding score: -15.751
InChIKey:PBRAATNPHCPQGU-UHFFFAOYSA-N
ID: 52531
SMILES:C(=C(CCC1(C(C)=C)C(C)=CCC1C(=C)C)C)Cc1c(O)c(C)cc(O)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 366.545
CB1 binding score: -14.605
InChIKey:NKKQCGVTLZAIHW-UHFFFAOYSA-N
ID: 52532
SMILES:c1(COC)cc(CCCCC)c(C2C=C(C)CCC2C(C)=C)cc1OC(CCCCC)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 440.668
CB1 binding score: -14.144
InChIKey:ZEXKPEKIICLGJH-UHFFFAOYSA-N
ID: 52533
SMILES:CC(=CC1C(C(C)=C)C1c1c(O)cc(CCCCCO)cc1OC)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -16.533
InChIKey:OWIQFHPIHLSZAA-UHFFFAOYSA-N
ID: 52534
SMILES:C(=CCc1c(O)cc(CCc2ccc(O)cc2)cc1O)(C)CCC=C(C)CCC=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 434.62
CB1 binding score: -19.427
InChIKey:VVBVATXKSUVSTB-UHFFFAOYSA-N
ID: 52535
SMILES:C(C)CCc1cc2c(c(O)c1)C1C(C(COC(=O)C(C)C)=C)CCC(C)=C1CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 396.571
CB1 binding score: -16.427
InChIKey:RJNVZQKFVZUFTF-UHFFFAOYSA-N
ID: 52536
SMILES:C(c1cc(O)c2c(c1)OC(C)(C)C1CC=C(C)C(O)C21)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.343
CB1 binding score: -15.288
InChIKey:MSGJVYQNHQDPTL-UHFFFAOYSA-N
ID: 52537
SMILES:C1Oc2c(c(O)cc(CCCCC)c2)C1C=CC(=O)O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 276.332
CB1 binding score: -15.095
InChIKey:OPBZRSWQAYOEAP-UHFFFAOYSA-N
ID: 52538
SMILES:CCCCCc1cc2c(c(O)c1)C1(C)C(C=CC(C)(C)O1)O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.414
CB1 binding score: -15.655
InChIKey:IZYUZTFLQTWSJK-UHFFFAOYSA-N
ID: 52539
SMILES:c1(C)cc2c(cc1O)-c3c(O)cc(CCCCC)cc3OC(C)C1C2(C)C2C(C(C(C)C)CC1)OC(=O)C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 520.71
CB1 binding score: -15.339
InChIKey:NSVXXFCOAYGXFB-UHFFFAOYSA-N
ID: 52540
SMILES:C(C(C)=CCCC(=CCc1c(O)c(C(=O)O)c(CCCCC)cc1O)C)CC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 428.613
CB1 binding score: -18.353
InChIKey:QNRJPRFPLQBROG-UHFFFAOYSA-N
ID: 52541
SMILES:c1c(C2C3C(CCC(C)=C3)C2(C)C)c(OC)cc(CCCCC)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.524
CB1 binding score: -14.437
InChIKey:NUTOOMUTSQCUHX-UHFFFAOYSA-N
ID: 52542
SMILES:O=C(OC1CC(C(C)C)C(c2c(O)cc(CCCCC)cc2OC)CC1C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 390.564
CB1 binding score: -16.055
InChIKey:NUJWMXDLWPHOSJ-UHFFFAOYSA-N