CHEBI:162596 - Pro-Pro-Ile

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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 Pro-Pro-Ile
ChEBI ID CHEBI:162596
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C16H27N3O4
Net Charge 0
Average Mass 325.409
Monoisotopic Mass 325.20016
InChI InChI=1S/C16H27N3O4/c1-3-10(2)13(16(22)23)18-14(20)12-7-5-9-19(12)15(21)11-6-4-8-17-11/h10-13,17H,3-9H2,1-2H3,(H,18,20)(H,22,23)/t10-,11-,12-,13-/m0/s1
InChIKey DWPXHLIBFQLKLK-CYDGBPFRSA-N
SMILES O=C(N1[C@@H](CCC1)C(=O)N[C@@H]([C@H](CC)C)C(O)=O)[C@H]2NCCC2
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 Pro-Pro-Ile (CHEBI:162596) is a oligopeptide (CHEBI:25676)
IUPAC Name
(2S,3S)-3-methyl-2-[[(2S)-1-[(2S)-pyrrolidine-2-carbonyl]pyrrolidine-2-carbonyl]amino]pentanoic acid
Manual Xref Database
58808793 ChemSpider
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