CHEBI:16622 - 3-dehydro-2-deoxy-D-gluconic acid

ChEBI IDCHEBI:16622
ChEBI Name3-dehydro-2-deoxy-D-gluconic acid
Stars
ASCII Name3-dehydro-2-deoxy-D-gluconic acid
DefinitionThe 3-dehydro-2-deoxy derivative of D-gluconic acid.
Secondary ChEBI IDsCHEBI:1481, CHEBI:11774, CHEBI:19990
Last Modified7 January 2019
DownloadsMolfile
FormulaC6H10O6
Net Charge0
Average Mass178.140
Monoisotopic Mass178.04774
SMILESO=C(O)CC(=O)[C@H](O)[C@H](O)CO
WURCSWURCS=2.0/1,1,0/[AdO22h]/1/
InChIInChI=1S/C6H10O6/c7-2-4(9)6(12)3(8)1-5(10)11/h4,6-7,9,12H,1-2H2,(H,10,11)/t4-,6+/m1/s1
InChIKeyCNLFCQPCBQQMHK-XINAWCOVSA-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)
3-dehydro-2-deoxy-D-gluconic acid (CHEBI:16622) has functional parent D-gluconic acid (CHEBI:33198)
3-dehydro-2-deoxy-D-gluconic acid (CHEBI:16622) is a hexonic acid (CHEBI:33752)
3-dehydro-2-deoxy-D-gluconic acid (CHEBI:16622) is a ketoaldonic acid (CHEBI:24963)
3-dehydro-2-deoxy-D-gluconic acid (CHEBI:16622) is conjugate acid of 3-dehydro-2-deoxy-D-gluconate (CHEBI:57839)
Incoming Relation(s)
3-dehydro-2-deoxy-D-gluconate (CHEBI:57839) is conjugate base of 3-dehydro-2-deoxy-D-gluconic acid (CHEBI:16622)
IUPAC Name 
2-deoxy-D-erythro-hex-3-ulosonic acid
Synonyms  Source
3-dehydro-2-deoxy-D-gluconateChEBI
3-Dehydro-2-deoxy-D-gluconateKEGG COMPOUND
Manual XrefsDatabases
C03926KEGG COMPOUND
C03926KEGG COMPOUND