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Chemical structure of Naltrexone-d3

GC40254

Naltrexone-d3

Also known as (4R,4aS,7aR,12bS)-3-[dideuterio-(1-deuteriocyclopropyl)methyl]-4a,9-dihydroxy-2,4,5,6,7a,13-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinolin-7-one

Naltrexone-d3 is an analytical reference material intended for use as an internal standard for the quantification of naltrexone by GC- or LC-MS

ChemicalCAS1261080-26-5MW344.4FormulaC20H20D3NO4
CAS number
1261080-26-5
Molecular weight
344.4
Formula
C20H20D3NO4
Solubility
Soluble in DMSO
InChIKey
DQCKKXVULJGBQN-VOVHGNGRSA-N
Catalogue number
GC40254
Brand
GLPBIO
Computed properties PubChem CID 45039987 · XLogP 1.9 · TPSA 70 Ų · H-bond donors 2
XLogP
1.9
TPSA
70 Ų
H-bond donors
2
H-bond acceptors
5
Rotatable bonds
2
Heavy atoms
25

SMILES [2H]C1(CC1)C([2H])([2H])N2CC[C@]34[C@@H]5C(=O)CC[C@]3([C@H]2CC6=C4C(=C(C=C6)O)O5)O

Computed descriptors from PubChem (CID 45039987), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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