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Chemical structure of Ac-Ala-OH-d3

GC68598

Ac-Ala-OH-d3

Also known as (2S)-2-acetamido-3,3,3-trideuteriopropanoic acid

Ac-Ala-OH-d3 is the deuterated form of Ac-Ala-OH· Ac-Ala-OH is an endogenous metabolite

ChemicalCAS1485548-36-4MW134.15FormulaC5H6D3NO3
CAS number
1485548-36-4
Molecular weight
134.15
Formula
C5H6D3NO3
InChIKey
KTHDTJVBEPMMGL-SRQSVDBESA-N
Catalogue number
GC68598
Brand
GLPBIO
Computed properties PubChem CID 129677003 · XLogP -0.9 · TPSA 66.4 Ų · H-bond donors 2
XLogP
-0.9
TPSA
66.4 Ų
H-bond donors
2
H-bond acceptors
3
Rotatable bonds
2
Heavy atoms
9

SMILES [2H]C([2H])([2H])[C@@H](C(=O)O)NC(=O)C

Computed descriptors from PubChem (CID 129677003), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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