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CHEBI:142691 - N-octanoyl-(2S)-hydroxyglycinate

ChEBI IDCHEBI:142691
ChEBI NameN-octanoyl-(2S)-hydroxyglycinate
Stars
ASCII NameN-octanoyl-(2S)-hydroxyglycinate
DefinitionAn N-acyl-(2S)-hydroxyglycinate resulting from the deprotonation of the carboxy group of N-octanoyl-(2S)-hydroxyglycine. The major species at pH 7.3.
Last Modified5 December 2018
Submitternhn
DownloadsMolfile
FormulaC10H18NO4
Net Charge-1
Average Mass216.257
Monoisotopic Mass216.12413
SMILESCCCCCCCC(=O)N[C@@H](O)C(=O)[O-]
InChIInChI=1S/C10H19NO4/c1-2-3-4-5-6-7-8(12)11-9(13)10(14)15/h9,13H,2-7H2,1H3,(H,11,12)(H,14,15)/p-1/t9-/m0/s1
InChIKeyHBGXZSWRZZHJKJ-VIFPVBQESA-M
ChEBI Ontology
Outgoing Relation(s)
N-octanoyl-(2S)-hydroxyglycinate (CHEBI:142691) is a N-acyl-(2S)-hydroxyglycinate (CHEBI:142687)
N-octanoyl-(2S)-hydroxyglycinate (CHEBI:142691) is conjugate base of N-octanoyl-(2S)-hydroxyglycine (CHEBI:142745)
Incoming Relation(s)
N-octanoyl-(2S)-hydroxyglycine (CHEBI:142745) is conjugate acid of N-octanoyl-(2S)-hydroxyglycinate (CHEBI:142691)
IUPAC Name 
(2S)-hydroxy(octanoylamino)acetate
Synonyms  Source
N-caprylyl-(2S)-hydroxyglycinateChEBI
(2S)-(caprylylamino)(hydroxy)acetateChEBI
UniProt Name  Source
N-octanoyl-(2S)-hydroxyglycineUniProt
Citations