ID: 37444
SMILES:C1(=O)CC(C(=C)C)C(c2c(O)cc(CCCCC)cc2)C=C1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.453
CB1 binding score: -16.495
InChIKey:VFLHTHNUQQKPQR-UHFFFAOYSA-N
ID: 37445
SMILES:C(C)CCCc1c(C(O)=O)c(O)c(CC=C(CCC=C(C)C)C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -19.234
InChIKey:SEEZIOZEUUMJME-UHFFFAOYSA-N
ID: 37446
SMILES:O=CC1Cc2c(cc(CCCCC)cc2O)OC1C1(C)OC(C(C)(C)O)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 390.52
CB1 binding score: -12.123
InChIKey:WICMDTDWMWZWCA-UHFFFAOYSA-N
ID: 37447
SMILES:CC12Cc3c(c(C(O)=O)c(CCCCC)cc3O)OC(C1(O)C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 348.439
CB1 binding score: -15.588
InChIKey:XJPVHINLBMFNPR-UHFFFAOYSA-N
ID: 37448
SMILES:Cc1c(C2C(C(C)C)CCC(CO)=C2)c(O)cc(CCCC)c1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -13.433
InChIKey:KSCDDXUWECXSRT-UHFFFAOYSA-N
ID: 37449
SMILES:C12(O)CC(C)=CCC1C(C)(C)Oc1cc(CCC)cc(OC3OC(CO)C(O)C(O)C3O)c12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 464.555
CB1 binding score: -14.864
InChIKey:LEFARANSIQGPCK-UHFFFAOYSA-N
ID: 37450
SMILES:C(Cc1cc(O)c2c(c1)OC(C)(C)C1CC=C(C)CCC12C)(=O)c1ccccc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 390.523
CB1 binding score: -15.12
InChIKey:MYQNBPUSIKSKAA-UHFFFAOYSA-N
ID: 37451
SMILES:CC1(C)Oc2c(c(O)cc(CCCCC)c2)C2C1CC(O)C(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -19.534
InChIKey:INKUWBOHCFHXTJ-UHFFFAOYSA-N
ID: 37452
SMILES:C1C(C)(C)C2C(c3c(O)cc(CCCCC)cc3O1)CC(C)=CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -17.093
InChIKey:UIOHIVFVWROLRA-UHFFFAOYSA-N
ID: 37453
SMILES:CC1=CC(c2c(O)cc(CCCCC)cc2OC)C(C(C)C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.512
CB1 binding score: -21.398
InChIKey:WPVARKYNWHKQMW-UHFFFAOYSA-N
ID: 37454
SMILES:COc1c(C(=O)CCCCC)c2c(c(O)c1)OC(C)(C)C1CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.505
CB1 binding score: -15.91
InChIKey:AHEPEAKEQSTYAK-UHFFFAOYSA-N
ID: 37455
SMILES:c1(CCCCC)cc(O)c(C2C(C(C)=C)CCC(C)=C2)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.427
InChIKey:QHMBSVQNZZTUGM-UHFFFAOYSA-N
ID: 37456
SMILES:c1(CCCCC)cc2c(c(O)c1)C1C(C(C)(O)CCC1C(C)C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -18.961
InChIKey:CNKSTABSFLNANJ-UHFFFAOYSA-N
ID: 37457
SMILES:c12c(c(O)cc(CCCCC)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: 37458
SMILES:C12C(CC=C(C)C1)C(C)(C)Oc1c2ccc(O)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 244.334
CB1 binding score: -18.541
InChIKey:DXDRGIVLXHOGHC-UHFFFAOYSA-N
ID: 37459
SMILES:c1(CCCC)cc2c(c(O)c1)C1C(CC=C(C)C)C3(C)C2C1CC(C)C3C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Polyprenylated cyclic polyketides (Hop meroterpenoids)
MW: 366.589
CB1 binding score: -14.981
InChIKey:RNPIIYOJNMPUDX-UHFFFAOYSA-N
ID: 37460
SMILES:C(=C(C)C)CCC(=CCc1c(O)cc(CCCCC)c(O)c1OC(=O)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.521
CB1 binding score: -17.456
InChIKey:NQWZDPKQSSITCN-UHFFFAOYSA-N
ID: 37461
SMILES:C1(C)(C)C2(Oc3c(c(O)cc(CCCCO)c3)C2)OC2C(OC)(C(O)C1)C=C(C(=O)O)CC2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 462.539
CB1 binding score: -14.842
InChIKey:HBCTZZSBZZQAFH-UHFFFAOYSA-N
ID: 37462
SMILES:C(C=C(C)C)C12Oc3c(c(O)cc(CCCCC)c3)C(O)(C)C1O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.44
CB1 binding score: -14.42
InChIKey:QBBSKWDDLFDRPO-UHFFFAOYSA-N
ID: 37463
SMILES:C(C)CCCc1c(C(O)=O)c(O)c(CC=C(CCC=C(C)C)C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -19.234
InChIKey:SEEZIOZEUUMJME-UHFFFAOYSA-N
ID: 37464
SMILES:C1(O)C(C)=CC2c3c(O)cc(CCCCC)cc3OC(C)(C)C2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -19.534
InChIKey:INKUWBOHCFHXTJ-UHFFFAOYSA-N