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Chemical structure of Indole-3-pyruvic acid-d5

GC77064

Indole-3-pyruvic acid-d5

Also known as 2-oxo-3-(2,4,5,6,7-pentadeuterio-1H-indol-3-yl)propanoic acid

Indole-3-pyruvic acid-d5 is deuterated labeled Indole-3-pyruvic acid

ChemicalCAS85163-57-1MW208.22FormulaC11H4D5NO3
CAS number
85163-57-1
Molecular weight
208.22
Formula
C11H4D5NO3
Solubility
H2O: 20 mg/mL (96·05 mM; Need ultrasonic and warming)
InChIKey
RSTKLPZEZYGQPY-SNOLXCFTSA-N
Catalogue number
GC77064
Brand
GLPBIO
Computed properties PubChem CID 102472945 · XLogP 1.3 · TPSA 70.2 Ų · H-bond donors 2
XLogP
1.3
TPSA
70.2 Ų
H-bond donors
2
H-bond acceptors
3
Rotatable bonds
3
Heavy atoms
15

SMILES [2H]C1=C(C(=C2C(=C1[2H])C(=C(N2)[2H])CC(=O)C(=O)O)[2H])[2H]

Computed descriptors from PubChem (CID 102472945), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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