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CHEBI:73968 - 2,3,5-trihydroxy-4-phosphonooxyadipic acid

ChEBI IDCHEBI:73968
ChEBI Name2,3,5-trihydroxy-4-phosphonooxyadipic acid
Stars
DefinitionAn α,ω-dicarboxylic acid and phosphate monoester that is adipic acid with a phosphate group at position 4 and hydroxy groups at positions 2, 3, and 5.
Last Modified25 September 2013
Submittermwilliams
DownloadsMolfile
FormulaC6H11O11P
Net Charge0
Average Mass290.117
Monoisotopic Mass290.00390
SMILESO=C(O)C(O)C(O)C(OP(=O)(O)O)C(O)C(=O)O
InChIInChI=1S/C6H11O11P/c7-1(2(8)5(10)11)4(3(9)6(12)13)17-18(14,15)16/h1-4,7-9H,(H,10,11)(H,12,13)(H2,14,15,16)
InChIKeyFJYQVOPLAANXAB-UHFFFAOYSA-N
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
Biological Role:
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
ChEBI Ontology
Outgoing Relation(s)
2,3,5-trihydroxy-4-phosphonooxyadipic acid (CHEBI:73968) has functional parent adipic acid (CHEBI:30832)
2,3,5-trihydroxy-4-phosphonooxyadipic acid (CHEBI:73968) has role metabolite (CHEBI:25212)
2,3,5-trihydroxy-4-phosphonooxyadipic acid (CHEBI:73968) is a phosphate monoester (CHEBI:7794)
2,3,5-trihydroxy-4-phosphonooxyadipic acid (CHEBI:73968) is a triol (CHEBI:27136)
2,3,5-trihydroxy-4-phosphonooxyadipic acid (CHEBI:73968) is a α,ω-dicarboxylic acid (CHEBI:28383)
IUPAC Name 
3-O-phosphonohexaric acid
Synonym  Source
2,3,5-trihydroxy-4-phosphonooxyhexanedioic acidChEBI