CHEBI:189314 - Octadecyl N-(butoxycarbonyl)alaninate

ChEBI IDCHEBI:189314
ChEBI NameOctadecyl N-(butoxycarbonyl)alaninate
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC26H51NO4
Net Charge0
Average Mass441.697
Monoisotopic Mass441.38181
SMILESCCCCCCCCCCCCCCCCCCOC(=O)[C@H](C)NC(=O)OCCCC
InChIInChI=1S/C26H51NO4/c1-4-6-8-9-10-11-12-13-14-15-16-17-18-19-20-21-23-30-25(28)24(3)27-26(29)31-22-7-5-2/h24H,4-23H2,1-3H3,(H,27,29)/t24-/m0/s1
InChIKeyOBPINUBELRNMIF-DEOSSOPVSA-N
Species of MetaboliteComponentSourceComments
Arabidopsis thaliana (ncbitaxon:3702) leaf (BTO:0000713) MetaboLights (MTBLS3997)
ChEBI Ontology
Outgoing Relation(s)
Octadecyl N-(butoxycarbonyl)alaninate (CHEBI:189314) is a α-amino acid ester (CHEBI:46874)
IUPAC Name 
octadecyl (2S)-2-(butoxycarbonylamino)propanoate
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20140121ChemSpider