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Product Overview

Product Code

TRC-C432812

CAS Number

1279033-13-4

Product Format

Neat

Molecular Formula

C18 D11 H14 N O8

Molecular Weight

394.461

API Family

Ciclopirox

Product Categories

TRC, Stable isotopes, Stable Isotope Labelled Analytical Standards, Pharmaceutical Toxicology Reference Materials , API Reference Standards & Research Materials

Product Type

Stable Isotope Labelled, API

Unlabelled CAS Number

79419-54-8

Documentation

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Product Information

Chemical Data

Analyte Name

Ciclopirox-d11 beta-D-Glucuronide

CAS Number

1279033-13-4

Molecular Formula

C18 D11 H14 N O8

Molecular Weight

394.461

Accurate Mass

394.227

SMILES

[2H]C1([2H])C([2H])([2H])C([2H])([2H])C([2H])(C2=CC(=CC(=O)N2O[C@@H]3O[C@@H]([C@@H](O)[C@H](O)[C@H]3O)C(=O)O)C)C([2H])([2H])C1([2H])[2H]

InChI

InChI=1S/C18H25NO8/c1-9-7-11(10-5-3-2-4-6-10)19(12(20)8-9)27-18-15(23)13(21)14(22)16(26-18)17(24)25/h7-8,10,13-16,18,21-23H,2-6H2,1H3,(H,24,25)/t13-,14-,15+,16-,18-/m0/s1/i2D2,3D2,4D2,5D2,6D2,10D

IUPAC

(2S,3S,4S,5R,6S)-3,4,5-trihydroxy-6-[4-methyl-2-oxo-6-(1,2,2,3,3,4,4,5,5,6,6-undecadeuteriocyclohexyl)pyridin-1-yl]oxyoxane-2-carboxylic acid

Unlabelled CAS Number

79419-54-8

SIL Type

Deuterium

Product Data

Storage Temperature

-20°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat

API Family

Ciclopirox

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