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CHEBI:72698 - (2R)-trihomocitric acid

ChEBI IDCHEBI:72698
ChEBI Name(2R)-trihomocitric acid
Stars
ASCII Name(2R)-trihomocitric acid
DefinitionA chiral tricarboxylic acid in which a central carbon carries hydroxy, carboxy, carboxymethyl and 4-carboxybutyl substituents with R-configuration at the chiral centre.
Secondary ChEBI IDCHEBI:133913
Last Modified20 April 2017
SubmitterAnne Morgat, Keeva
DownloadsMolfile
FormulaC9H14O7
Net Charge0
Average Mass234.204
Monoisotopic Mass234.07395
SMILESO=C(O)CCCC[C@@](O)(CC(=O)O)C(=O)O
InChIInChI=1S/C9H14O7/c10-6(11)3-1-2-4-9(16,8(14)15)5-7(12)13/h16H,1-5H2,(H,10,11)(H,12,13)(H,14,15)/t9-/m1/s1
InChIKeyYNPKOQYWJZNZGP-SECBINFHSA-N
Species of MetaboliteComponentSourceComments
Apis cerana (ncbitaxon:7461) - MetaboLights (MTBLS379)
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
(2R)-trihomocitric acid (CHEBI:72698) is a tricarboxylic acid (CHEBI:27093)
(2R)-trihomocitric acid (CHEBI:72698) is conjugate acid of (2R)-trihomocitrate(3−) (CHEBI:72699)
Incoming Relation(s)
(2R)-trihomocitrate(3−) (CHEBI:72699) is conjugate base of (2R)-trihomocitric acid (CHEBI:72698)
IUPAC Name 
(2R)-2-hydroxy-1,2,6-hexanetricarboxylic acid
Synonyms  Source
(2R)-(homo)3citric acidSUBMITTER
(R)-trihomocitric acidChEBI
(R)-2-Hydroxy-1,2,6-hexanetricarboxylic acidKEGG COMPOUND
Manual XrefsDatabases
CPD-301MetaCyc
C16598KEGG COMPOUND