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CHEBI:168371 - 4-Hydroxycitrulline

ChEBI IDCHEBI:168371
ChEBI Name4-Hydroxycitrulline
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC6H13N3O4
Net Charge0
Average Mass191.187
Monoisotopic Mass191.09061
SMILESNC(=O)NCC(O)CC(N)C(=O)O
InChIInChI=1S/C6H13N3O4/c7-4(5(11)12)1-3(10)2-9-6(8)13/h3-4,10H,1-2,7H2,(H,11,12)(H3,8,9,13)
InChIKeyWSFLFFUIEVIDJY-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Malus domestica (ncbitaxon:3750) exocarp (BTO:0000733) MetaboLights (MTBLS2384) Strain: Malus x domestica Borkh. cv. Ruixue
Roles Classification
Chemical Roles:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
4-Hydroxycitrulline (CHEBI:168371) is a α-amino acid (CHEBI:33704)
IUPAC Name 
2-amino-5-(carbamoylamino)-4-hydroxypentanoic acid
Manual XrefsDatabases
HMDB0029384HMDB
35032861ChemSpider