CHEBI:162689 - Pro-Thr-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 Pro-Thr-Thr
ChEBI ID CHEBI:162689
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C13H23N3O6
Net Charge 0
Average Mass 317.342
Monoisotopic Mass 317.15869
InChI InChI=1S/C13H23N3O6/c1-6(17)9(15-11(19)8-4-3-5-14-8)12(20)16-10(7(2)18)13(21)22/h6-10,14,17-18H,3-5H2,1-2H3,(H,15,19)(H,16,20)(H,21,22)/t6-,7-,8+,9+,10+/m1/s1
InChIKey GZNYIXWOIUFLGO-ZJDVBMNYSA-N
SMILES O=C(N[C@@H]([C@H](O)C)C(=O)N[C@@H]([C@H](O)C)C(O)=O)[C@H]1NCCC1
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 Pro-Thr-Thr (CHEBI:162689) is a peptide (CHEBI:16670)
IUPAC Name
(2S,3R)-3-hydroxy-2-[[(2S,3R)-3-hydroxy-2-[[(2S)-pyrrolidine-2-carbonyl]amino]butanoyl]amino]butanoic acid