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Chemical structure of Valproic acid-d15

GC70109

Valproic acid-d15

Also known as 2,3,3,4,4,5,5,5-octadeuterio-2-(1,1,2,2,3,3,3-heptadeuteriopropyl)pentanoic acid

Valproic acid-d15 is the deuterated form of Valproic acid· Valproic acid (VPA; 2-Propylpentanoic Acid) is an HDAC inhibitor with an IC50 value of 0·5-2 mM, inhibiting the activity of HDAC1 (IC50, 400 μM), while inducing the degradation of HDAC2· Valproic acid activates Notch1 signaling and inhibits proliferation in small cell lung cancer (SCLC) cells· Valproic acid can be used for research on epilepsy, bipolar disorder, and migraines

ChemicalCAS362049-65-8MW159.3FormulaC8HD15O2
CAS number
362049-65-8
Molecular weight
159.3
Formula
C8HD15O2
InChIKey
NIJJYAXOARWZEE-BKUSUEPDSA-N
Catalogue number
GC70109
Brand
GLPBIO
Computed properties PubChem CID 46832833 · XLogP 2.8 · TPSA 37.3 Ų · H-bond donors 1
XLogP
2.8
TPSA
37.3 Ų
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
5
Heavy atoms
10

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

Computed descriptors from PubChem (CID 46832833), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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