CHEBI:159578 - Asn-Asn-Met

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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-Asn-Met
ChEBI ID CHEBI:159578
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C13H23N5O6S
Net Charge 0
Average Mass 377.420
Monoisotopic Mass 377.13690
InChI InChI=1S/C13H23N5O6S/c1-25-3-2-7(13(23)24)17-12(22)8(5-10(16)20)18-11(21)6(14)4-9(15)19/h6-8H,2-5,14H2,1H3,(H2,15,19)(H2,16,20)(H,17,22)(H,18,21)(H,23,24)/t6-,7-,8-/m0/s1
InChIKey DXZNJWFECGJCQR-FXQIFTODSA-N
SMILES S(CC[C@H](NC(=O)[C@@H](NC(=O)[C@@H](N)CC(=O)N)CC(=O)N)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 )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing Asn-Asn-Met (CHEBI:159578) is a peptide (CHEBI:16670)
IUPAC Name
(2S)-2-[[(2S)-4-amino-2-[[(2S)-2,4-diamino-4-oxobutanoyl]amino]-4-oxobutanoyl]amino]-4-methylsulanylbutanoic acid