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Drug Details

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Name:1,3,4,5-tetra-O-galloylquinic acid
PubChem ID:124020
Pathway:Show KEGG pathways
InChI:InChI=1S/C35H28O22/c36-15-1-11(2-16(37)25(15)44)30(48)54-23-9-35(34(52)53,57-33(51)14-7-21(42)28(47)22(43)8-14)10-24(55-31(49)12-3-17(38)26(45)18(39)4-12)29(23)56-32(50)13-5-19(40)27(46)20(41)6-13/h1-8,23-24,29,36-47H,9-10H2,(H,52,53)/t23-,24-,29?,35?/m1/s1
SMILES:O=C(c1cc(O)c(c(c1)O)O)O[C@@H]1CC(C[C@H](C1OC(=O)c1cc(O)c(c(c1)O)O)OC(=O)c1cc(O)c(c(c1)O)O)(OC(=O)c1cc(O)c(c(c1)O)O)C(=O)O

Properties:
Formula:C35H28O22Atoms:57
Molecular Weight:800.584Rotatable Bonds:13
H-bond Acceptors:22H-bond Donors:13
logP:1.6046
Targets:
NameUniprot IDSourceReferencesInteraction
Protein kinase C alpha typeKPCA_HUMANBindingDB-shows
Synonyms:
()-oxazepam hemisuccinate sodium salt
(3R,5R)-1,3,4,5-tetrakis[(3,4,5-trihydroxybenzoyl)oxy]cyclohexane-1-carbox
1,3,4,5-Tetra-O-galloylquinic acid
1,3,4,5-TetragGQA
1,3,4,5-Tetragqa
109008-79-9
AC1L3XR4
AIDS-085500
AIDS085500
Benzoic acid, 3,4,5-trihydroxy-, tetramol. ester, 5-carboxy-2,3,5-trihydroxycyclohexyl ester, (1alpha,2beta,3beta,5beta)-
CHEBI:156463
CHEMBL36985
CID124020
NSC627861
NSC692278