CHEBI:159983 - Asn-Met-Pro

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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-Met-Pro
ChEBI ID CHEBI:159983
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C14H24N4O5S
Net Charge 0
Average Mass 360.430
Monoisotopic Mass 360.14674
InChI InChI=1S/C14H24N4O5S/c1-24-6-4-9(17-12(20)8(15)7-11(16)19)13(21)18-5-2-3-10(18)14(22)23/h8-10H,2-7,15H2,1H3,(H2,16,19)(H,17,20)(H,22,23)/t8-,9-,10+/m0/s1
InChIKey WCRQQIPFSXFIRN-LPEHRKFASA-N
SMILES S(CC[C@H](NC(=O)[C@@H](N)CC(=O)N)C(=O)N1[C@H](CCC1)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 Asn-Met-Pro (CHEBI:159983) is a peptide (CHEBI:16670)
IUPAC Name
(2R)-1-[(2S)-2-[[(2S)-2,4-diamino-4-oxobutanoyl]amino]-4-methylsulanylbutanoyl]pyrrolidine-2-carboxylic acid