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CHEBI:189216 - Deoxyvalidamine

ChEBI IDCHEBI:189216
ChEBI NameDeoxyvalidamine
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC7H15NO3
Net Charge0
Average Mass161.201
Monoisotopic Mass161.10519
SMILESN[C@H]1C[C@H](CO)[C@@H](O)C[C@H]1O
InChIInChI=1S/C7H15NO3/c8-5-1-4(3-9)6(10)2-7(5)11/h4-7,9-11H,1-3,8H2/t4-,5+,6+,7-/m1/s1
InChIKeyFFRMLFVGYPMNPT-JRTVQGFMSA-N
Species of MetaboliteComponentSourceComments
Arabidopsis thaliana (ncbitaxon:3702) leaf (BTO:0000713) MetaboLights (MTBLS3997)
ChEBI Ontology
Outgoing Relation(s)
Deoxyvalidamine (CHEBI:189216) is a cyclohexanols (CHEBI:23480)
IUPAC Name 
(1S,3R,4S,6R)-4-amino-6-(hydroxymethyl)cyclohexane-1,3-diol
Manual XrefsDatabases
113115ChemSpider
Registry NumbersSources
CAS:100157-27-5ChemIDplus