(2R)-5-hydroxy-3-oxo-2-[[(Z)-3-oxoprop-1-enyl]amino]pentanoic acid
(2R)-5-hydroxy-3-oxo-2-[[(Z)-3-oxoprop-1-enyl]amino]pentanoic acid
Molecular Identity
(2R)-5-hydroxy-3-oxo-2-[[(Z)-3-oxoprop-1-enyl]amino]pentanoic acid
(2R)-5-hydroxy-3-oxo-2-[[(Z)-3-oxoprop-1-enyl]amino]pentanoic acid
PubChem CID: 444593
2D Structure
Properties
C8H11NO5
Molecular Formula
201.18
Molecular Weight
g/mol
201.0637
Exact Mass
Da
-0.7
XLogP
Drug-like (Lipinski: < 5)
104
TPSA
Good oral absorption (< 140 A²)
3
H-Bond Donors
6
H-Bond Acceptors
248
Complexity
SMILES
Canonical SMILES
SMILES: C(CO)C(=O)C(C(=O)O)NC=CC=OIsomeric SMILES
SMILES: C(CO)C(=O)[C@H](C(=O)O)N/C=C\C=OSynonyms(2)
CEM(2R)-5-hydroxy-3-oxo-2-[[(Z)-3-oxoprop-1-enyl]amino]pentanoic acid
Data from PubChem (NCBI)
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Molecular Structure
(2R)-5-hydroxy-3-oxo-2-[[(Z)-3-oxoprop-1-enyl]amino]pentanoic acid
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Drug Network
Trials and conditions connected to (2R)-5-hydroxy-3-oxo-2-[[(Z)-3-oxoprop-1-enyl]amino]pentanoic acid
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