CHEBI:160489 - Asp-Gln-Gly

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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 Asp-Gln-Gly
ChEBI ID CHEBI:160489
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C11H18N4O7
Net Charge 0
Average Mass 318.286
Monoisotopic Mass 318.11755
InChI InChI=1S/C11H18N4O7/c12-5(3-8(17)18)10(21)15-6(1-2-7(13)16)11(22)14-4-9(19)20/h5-6H,1-4,12H2,(H2,13,16)(H,14,22)(H,15,21)(H,17,18)(H,19,20)/t5-,6-/m0/s1
InChIKey VHQOCWWKXIOAQI-WDSKDSINSA-N
SMILES O=C(NCC(O)=O)[C@@H](NC(=O)[C@@H](N)CC(O)=O)CCC(=O)N
Roles Classification
Chemical Role(s): Bronsted base
A molecular entity capable of accepting a hydron from a donor (Bronsted acid).
(via organic amino compound )
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ChEBI Ontology
Outgoing Asp-Gln-Gly (CHEBI:160489) is a peptide (CHEBI:16670)
IUPAC Name
(3S)-3-amino-4-[[(2S)-5-amino-1-(carboxymethylamino)-1,5-dioxopentan-2-yl]amino]-4-oxobutanoic acid