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CHEBI:176457 - Aldosine

ChEBI IDCHEBI:176457
ChEBI NameAldosine
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC12H18N2O4
Net Charge0
Average Mass254.286
Monoisotopic Mass254.12666
SMILESO=C(O)C1CCC(C2CCCC(C(=O)O)N2)=CN1
InChIInChI=1S/C12H18N2O4/c15-11(16)9-5-4-7(6-13-9)8-2-1-3-10(14-8)12(17)18/h6,8-10,13-14H,1-5H2,(H,15,16)(H,17,18)
InChIKeyFZNMMFIPIGBAJL-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) urine (BTO:0001419) MetaboLights (MTBLS2295)
Roles Classification
Chemical Roles:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
Aldosine (CHEBI:176457) is a α-amino acid (CHEBI:33704)
IUPAC Name 
5-(6-carboxypiperidin-2-yl)-1,2,3,4-tetrahydropyridine-2-carboxylic acid
Manual XrefsDatabases
28686448ChemSpider
HMDB0037817HMDB