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CHEBI:59201 - (2ξ)-D-gluco-heptonic acid

ChEBI IDCHEBI:59201
ChEBI Name(2ξ)-D-gluco-heptonic acid
Stars
ASCII Name(2xi)-D-gluco-heptonic acid
DefinitionAn unspecified mixture of (2R)- and 2(S)-D-gluco-heptonic acid.
Last Modified27 April 2010
SubmitterGareth Owen
DownloadsMolfile
FormulaC7H14O8
Net Charge0
Average Mass226.181
Monoisotopic Mass226.06887
SMILESO=C(O)C(O)[C@H](O)[C@@H](O)[C@H](O)[C@H](O)CO
WURCSWURCS=2.0/1,1,0/[Ax2122h]/1/
InChIInChI=1S/C7H14O8/c8-1-2(9)3(10)4(11)5(12)6(13)7(14)15/h2-6,8-13H,1H2,(H,14,15)/t2-,3-,4+,5-,6?/m1/s1
InChIKeyKWMLJOLKUYYJFJ-GASJEMHNSA-N
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
(2ξ)-D-gluco-heptonic acid (CHEBI:59201) is a carbohydrate acid (CHEBI:33720)
(2ξ)-D-gluco-heptonic acid (CHEBI:59201) is a monocarboxylic acid (CHEBI:25384)
(2ξ)-D-gluco-heptonic acid (CHEBI:59201) is conjugate acid of (2ξ)-D-gluco-heptonate (CHEBI:59200)
Incoming Relation(s)
(2ξ)-D-gluco-heptonate (CHEBI:59200) is conjugate base of (2ξ)-D-gluco-heptonic acid (CHEBI:59201)
IUPAC Name 
(2ξ)-D-gluco-heptonic acid
Synonyms  Source
(2ξ)-D-glycero-D-gulo-heptonic acidChEBI
(2ξ)-D-glycero-D-ido-heptonic acidChEBI