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CHEBI:190123 - Chondrosine

ChEBI IDCHEBI:190123
ChEBI NameChondrosine
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC12H21NO11
Net Charge0
Average Mass355.296
Monoisotopic Mass355.11146
SMILESN[C@@H](C=O)[C@@H](O[C@@H]1O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]1O)[C@@H](O)[C@H](O)CO
InChIInChI=1S/C12H21NO11/c13-3(1-14)9(5(17)4(16)2-15)23-12-8(20)6(18)7(19)10(24-12)11(21)22/h1,3-10,12,15-20H,2,13H2,(H,21,22)/t3-,4+,5-,6-,7-,8+,9+,10-,12+/m0/s1
InChIKeyWNWNYJSOBYTXFA-IJYCYIJYSA-N
Species of MetaboliteComponentSourceComments
Brassica napus (ncbitaxon:3708) flower (BTO:0000469) MetaboLights (MTBLS3950)
ChEBI Ontology
Outgoing Relation(s)
Chondrosine (CHEBI:190123) is a O-acyl carbohydrate (CHEBI:52782)
IUPAC Name 
(2S,3S,4S,5R,6R)-6-[(2R,3R,4S,5R)-2-amino-4,5,6-trihydroxy-1-oxohexan-3-yl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid
Manual XrefsDatabases
32697992ChemSpider
Registry NumbersSources
CAS:499-14-9ChemIDplus