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CHEBI:58864 - dehypoxanthine futalosinate

ChEBI IDCHEBI:58864
ChEBI Namedehypoxanthine futalosinate
Stars
DefinitionA 5-oxo monocarboxylic acid anion that is the conjugate base of dehypoxanthine futalosine.
Last Modified15 January 2014
DownloadsMolfile
FormulaC14H15O7
Net Charge-1
Average Mass295.267
Monoisotopic Mass295.08233
SMILESO=C([O-])c1cccc(C(=O)CC[C@H]2OC(O)[C@H](O)[C@@H]2O)c1
InChIInChI=1S/C14H16O7/c15-9(7-2-1-3-8(6-7)13(18)19)4-5-10-11(16)12(17)14(20)21-10/h1-3,6,10-12,14,16-17,20H,4-5H2,(H,18,19)/p-1/t10-,11-,12-,14?/m1/s1
InChIKeyXWPBBHHZDYSYMS-ZXRVKKJVSA-M
ChEBI Ontology
Outgoing Relation(s)
dehypoxanthine futalosinate (CHEBI:58864) is a 5-oxo monocarboxylic acid anion (CHEBI:35975)
dehypoxanthine futalosinate (CHEBI:58864) is conjugate base of dehypoxanthine futalosine (CHEBI:51312)
Incoming Relation(s)
dehypoxanthine futalosine (CHEBI:51312) is conjugate acid of dehypoxanthine futalosinate (CHEBI:58864)
IUPAC Name 
3-{3-[(2R,3S,4R)-3,4,5-trihydroxytetrahydrofuran-2-yl]propanoyl}benzoate
UniProt Name  Source
dehypoxanthine futalosineUniProt