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Product Overview

Product Code

TRC-T893002

CAS Number

1346601-60-2

Product Format

Neat

Molecular Formula

C20 D4 H11 F3 N4 O3 . C H4 O3 S

Molecular Weight

516.484

Unlabelled CAS Number

147059-75-4

Documentation

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Product Information

Analyte Name

Trovafloxacin-d4 Mesylate

CAS Number

1346601-60-2

Molecular Formula

C20 D4 H11 F3 N4 O3 . C H4 O3 S

Molecular Weight

516.484

Accurate Mass

516.123

SMILES

[2H]C1([2H])[C@@H]2C(N)[C@@H]2C([2H])([2H])N1c3nc4N(C=C(C(=O)O)C(=O)c4cc3F)c5ccc(F)cc5F.CS(=O)(=O)O

InChI

InChI=1S/C20H15F3N4O3.CH4O3S/c21-8-1-2-15(13(22)3-8)27-7-12(20(29)30)17(28)9-4-14(23)19(25-18(9)27)26-5-10-11(6-26)16(10)24;1-5(2,3)4/h1-4,7,10-11,16H,5-6,24H2,(H,29,30);1H3,(H,2,3,4)/t10-,11+,16?;/i5D2,6D2;

IUPAC

7-[(1R,5S)-6-amino-2,2,4,4-tetradeuterio-3-azabicyclo[3.1.0]hexan-3-yl]-1-(2,4-difluorophenyl)-6-fluoro-4-oxo-1,8-naphthyridine-3-carboxylic acid;methanesulfonic acid

Unlabelled CAS Number

147059-75-4

SIL Type

Deuterium

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Type

Bioactive small molecule; Stable Isotope Labelled; API

Product Format

Neat

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