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Chemical structure of Cefadroxil-d4 (trifluoroacetate salt)

GC48489

Cefadroxil-d4 (trifluoroacetate salt)

Also known as (6R,7R)-7-[[(2R)-2-amino-2-(2,3,5,6-tetradeuterio-4-hydroxyphenyl)acetyl]amino]-3-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid;2,2,2-trifluoroacetic acid

An internal standard for the quantification of cefadroxil

ChemicalCAS1426215-61-3MW481.4FormulaC16H13D4N3O5S•CF3COOH
CAS number
1426215-61-3
Molecular weight
481.4
Formula
C16H13D4N3O5S•CF3COOH
Solubility
DMSO: soluble,Methanol: soluble,Water: soluble
InChIKey
PQRAWSCYCASBIK-AUTKPGNWSA-N
Catalogue number
GC48489
Brand
GLPBIO
Computed properties PubChem CID 156588941 · TPSA 196 Ų · H-bond donors 5 · H-bond acceptors 12
TPSA
196 Ų
H-bond donors
5
H-bond acceptors
12
Rotatable bonds
4
Heavy atoms
32

SMILES [2H]C1=C(C(=C(C(=C1[C@H](C(=O)N[C@H]2[C@@H]3N(C2=O)C(=C(CS3)C)C(=O)O)N)[2H])[2H])O)[2H].C(=O)(C(F)(F)F)O

Computed descriptors from PubChem (CID 156588941), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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