Gln-Ile (CHEBI:157833)

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ChEBI Ontology

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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	Gln-Ile

ChEBI ID	CHEBI:157833

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

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C11H21N3O4

Net Charge

Average Mass

259.306

Monoisotopic Mass

259.15321

InChI

InChI=1S/C11H21N3O4/c1-3-6(2)9(11(17)18)14-10(16)7(12)4-5-8(13)15/h6-7,9H,3-5,12H2,1-2H3,(H2,13,15)(H,14,16)(H,17,18)/t6-,7-,9-/m0/s1

InChIKey

XITLYYAIPBBHPX-ZKWXMUAHSA-N

SMILES

OC(=O)[C@@H](NC(=O)[C@@H](N)CCC(=O)N)[C@H](CC)C

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

ChEBI Ontology
Outgoing	Gln-Ile (CHEBI:157833) is a dipeptide (CHEBI:46761)

IUPAC Name

(2S,3S)-2-[[(2S)-2,5-diamino-5-oxopentanoyl]amino]-3-methylpentanoic acid