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CHEBI:232370 - 3,4,5-tri-O-galloylquinic acid

ChEBI IDCHEBI:232370
ChEBI Name3,4,5-tri-O-galloylquinic acid
Stars
SubmitterFlyBase
DownloadsMolfile
FormulaC28H24O18
Net Charge0
Average Mass648.482
Monoisotopic Mass648.09626
SMILES[H]C1(OC(=O)c2cc(O)c(O)c(O)c2)[C@]([H])(OC(=O)c2cc(O)c(O)c(O)c2)CC(O)(C(=O)O)C[C@@]1([H])OC(=O)c1cc(O)c(O)c(O)c1
InChIInChI=1S/C28H24O18/c29-12-1-9(2-13(30)20(12)35)24(38)44-18-7-28(43,27(41)42)8-19(45-25(39)10-3-14(31)21(36)15(32)4-10)23(18)46-26(40)11-5-16(33)22(37)17(34)6-11/h1-6,18-19,23,29-37,43H,7-8H2,(H,41,42)/t18-,19-,23?,28?/m1/s1
InChIKeyPEOHIPMSHPWYAQ-IOALSNHGSA-N
Wikipedia
ChEBI Ontology
Outgoing Relation(s)
3,4,5-tri-O-galloylquinic acid (CHEBI:232370) is a DNA polymerase inhibitor (CHEBI:38234)
Manual XrefsDatabases
https://en.wikipedia.org/wiki/3,4,5-Tri-O-galloylquinic_acidWikipedia
Registry NumbersSources
CAS:99745-62-7SUBMITTER
Citations