CHEBI:159947 - Asn-Lys-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 Asn-Lys-Thr
ChEBI ID CHEBI:159947
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C14H27N5O6
Net Charge 0
Average Mass 361.399
Monoisotopic Mass 361.19613
InChI InChI=1S/C14H27N5O6/c1-7(20)11(14(24)25)19-13(23)9(4-2-3-5-15)18-12(22)8(16)6-10(17)21/h7-9,11,20H,2-6,15-16H2,1H3,(H2,17,21)(H,18,22)(H,19,23)(H,24,25)/t7-,8+,9+,11+/m1/s1
InChIKey AYOAHKWVQLNPDM-HJGDQZAQSA-N
SMILES O=C(N[C@@H]([C@H](O)C)C(O)=O)[C@@H](NC(=O)[C@@H](N)CC(=O)N)CCCCN
Roles Classification
Chemical Role(s): Bronsted base
A molecular entity capable of accepting a hydron from a donor (Bronsted acid).
(via organic amino compound )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing Asn-Lys-Thr (CHEBI:159947) is a peptide (CHEBI:16670)
IUPAC Name
(2S,3R)-2-[[(2S)-6-amino-2-[[(2S)-2,4-diamino-4-oxobutanoyl]amino]hexanoyl]amino]-3-hydroxybutanoic acid