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CHEBI:133217 - bisorcic

ChEBI IDCHEBI:133217
ChEBI Namebisorcic
Stars
DefinitionAn N-acetyl-L-amino acid that is L-ornithine carrying two acetyl substituents at positions N-2 and N-5.
Last Modified22 February 2017
SubmitterSteve
DownloadsMolfile
FormulaC9H16N2O4
Net Charge0
Average Mass216.237
Monoisotopic Mass216.11101
SMILESCC(=O)NCCC[C@H](NC(C)=O)C(=O)O
InChIInChI=1S/C9H16N2O4/c1-6(12)10-5-3-4-8(9(14)15)11-7(2)13/h8H,3-5H2,1-2H3,(H,10,12)(H,11,13)(H,14,15)/t8-/m0/s1
InChIKeyXUYANFPPYJSBPU-QMMMGPOBSA-N
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
bisorcic (CHEBI:133217) is a N-acetyl-L-amino acid (CHEBI:21545)
bisorcic (CHEBI:133217) is a L-ornithine derivative (CHEBI:21368)
bisorcic (CHEBI:133217) is conjugate acid of bisorcic(1−) (CHEBI:133209)
Incoming Relation(s)
bisorcic(1−) (CHEBI:133209) is conjugate base of bisorcic (CHEBI:133217)
IUPAC Name 
N2,N5-diacetyl-L-ornithine
INNs  Source
bisorcicumChemIDplus
bisorcicoChemIDplus
bisorcicChemIDplus
Synonym  Source
N2,N5-diacetylornithineChEBI
Manual XrefsDatabases
381DrugCentral
Registry NumbersSources
Reaxys:1712784Reaxys
CAS:39825-23-5ChemIDplus