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Chemical structure of N-Isovalerylglycine-d9

GC69564

N-Isovalerylglycine-d9

Also known as 2-[[2,2,3,4,4,4-hexadeuterio-3-(trideuteriomethyl)butanoyl]amino]acetic acid

N-Isovalerylglycine-d9 is the deuterated form of N-Isovaleroylglycine· N-Isovaleroylglycine is an acylglycine that can serve as a biomarker for weight gain and obesity

ChemicalCAS1330037-21-2MW168.24FormulaC7H4D9NO3
CAS number
1330037-21-2
Molecular weight
168.24
Formula
C7H4D9NO3
Solubility
DMSO ： 100 mg/mL (594·39 mM; Need ultrasonic)
InChIKey
ZRQXMKMBBMNNQC-APXHDBETSA-N
Catalogue number
GC69564
Brand
GLPBIO
Computed properties PubChem CID 131668326 · XLogP 1.5 · TPSA 66.4 Ų · H-bond donors 2
XLogP
1.5
TPSA
66.4 Ų
H-bond donors
2
H-bond acceptors
3
Rotatable bonds
4
Heavy atoms
11

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

Computed descriptors from PubChem (CID 131668326), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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