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CHEBI:165575 - N-Stearoyl valine

ChEBI IDCHEBI:165575
ChEBI NameN-Stearoyl valine
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SubmitterMetaboLights
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FormulaC23H45NO3
Net Charge0
Average Mass383.617
Monoisotopic Mass383.33994
SMILESCCCCCCCCCCCCCCCCCC(=O)N[C@H](C(=O)O)C(C)C
InChIInChI=1S/C23H45NO3/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-21(25)24-22(20(2)3)23(26)27/h20,22H,4-19H2,1-3H3,(H,24,25)(H,26,27)/t22-/m0/s1
InChIKeySIPMISGYHBUSIB-QFIPXVFZSA-N
ChEBI Ontology
Outgoing Relation(s)
N-Stearoyl valine (CHEBI:165575) is a valine derivative (CHEBI:27267)
IUPAC Name 
(2S)-3-methyl-2-(octadecanoylamino)butanoic acid
Manual XrefsDatabases
LMFA08020122LIPID MAPS
35142255ChemSpider