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Chemical structure of Enalaprilat D5 Sodium Salt

GC35984

Enalaprilat D5 Sodium Salt

Also known as disodium;(2S)-1-[(2S)-2-[[(1S)-1-carboxylato-3-(2,3,4,5,6-pentadeuteriophenyl)propyl]amino]propanoyl]pyrrolidine-2-carboxylate

Enalaprilat (MK-422) D5 Sodium Salt is the deuterium labeled Enalaprilat(MK-422), which is an angiotensin-converting enzyme (ACE) inhibitor

ChemicalCAS1356922-29-6MW397.39FormulaC18H17D5N2Na2O5
CAS number
1356922-29-6
Molecular weight
397.39
Formula
C18H17D5N2Na2O5
Solubility
Water： ≥ 100 mg/mL (251·64 mM)
InChIKey
HTOMWWZYNPLIET-CGGLEDJRSA-L
Catalogue number
GC35984
Brand
GLPBIO
Computed properties PubChem CID 92044428 · TPSA 113 Ų · H-bond donors 1 · H-bond acceptors 6
TPSA
113 Ų
H-bond donors
1
H-bond acceptors
6
Rotatable bonds
6
Heavy atoms
27

SMILES [2H]C1=C(C(=C(C(=C1[2H])[2H])CC[C@@H](C(=O)[O-])N[C@@H](C)C(=O)N2CCC[C@H]2C(=O)[O-])[2H])[2H].[Na+].[Na+]

Computed descriptors from PubChem (CID 92044428), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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