CHEBI:162684 - Glu-Ala-Thr

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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 Glu-Ala-Thr
ChEBI ID CHEBI:162684
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C12H21N3O7
Net Charge 0
Average Mass 319.314
Monoisotopic Mass 319.13795
InChI InChI=1S/C12H21N3O7/c1-5(10(19)15-9(6(2)16)12(21)22)14-11(20)7(13)3-4-8(17)18/h5-7,9,16H,3-4,13H2,1-2H3,(H,14,20)(H,15,19)(H,17,18)(H,21,22)/t5-,6+,7-,9-/m0/s1
InChIKey FYBSCGZLICNOBA-XQXXSGGOSA-N
SMILES O[C@@H]([C@H](NC(=O)[C@@H](NC(=O)[C@@H](N)CCC(O)=O)C)C(O)=O)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 )
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ChEBI Ontology
Outgoing Glu-Ala-Thr (CHEBI:162684) is a peptide (CHEBI:16670)
IUPAC Name
(4S)-4-amino-5-[[(2S)-1-[[(1S,2R)-1-carboxy-2-hydroxypropyl]amino]-1-oxopropan-2-yl]amino]-5-oxopentanoic acid