DL-Ornithino-L-alanine (CHEBI:168570)

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.

ChEBI Name	DL-Ornithino-L-alanine

ChEBI ID	CHEBI:168570

Stars	This entity has been manually annotated by a third party.

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C8H17N3O4

Net Charge

Average Mass

219.241

Monoisotopic Mass

219.12191

InChI

InChI=1S/C8H17N3O4/c9-5(7(12)13)2-1-3-11-4-6(10)8(14)15/h5-6,11H,1-4,9-10H2,(H,12,13)(H,14,15)

InChIKey

BKYZUPUACXSQQT-UHFFFAOYSA-N

SMILES

OC(=O)C(N)CCCNCC(N)C(O)=O

Metabolite of Species	Details
Malus domestica (NCBI:txid3750)	Found in exocarp (BTO:0000733). of strain Malus x domestica Borkh. cv. Ruixue See: MetaboLights Study

Roles Classification
Chemical Role(s):	Bronsted base A molecular entity capable of accepting a hydron from a donor (Bronsted acid). (via organic amino compound ) Bronsted acid A molecular entity capable of donating a hydron to an acceptor (Bronsted base). (via oxoacid )

ChEBI Ontology
Outgoing	DL-Ornithino-L-alanine (CHEBI:168570) is a α-amino acid (CHEBI:33704)

IUPAC Name

2-amino-5-[(2-amino-2-carboxyethyl)amino]pentanoic acid