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Product Overview

Product Code

TRC-A674035

Product Format

Neat

Molecular Formula

C26H40Cl2N2O6S

Molecular Weight

579.58

Product Categories

TRC, Impurity Reference Materials

Alternate CAS Number

25908-42-3

Documentation

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Product Information

Chemical Data

Analyte Name

3,4-O-p-Anisylideneclindamycin Hydrochloride

Molecular Formula

C26H40Cl2N2O6S

Molecular Weight

579.58

Accurate Mass

578.2

SMILES

O[C@@H]([C@@H](SC)O1)[C@@H](O2)[C@@H](OC2C3=CC=C(OC)C=C3)[C@H]1C(C(Cl)C)NC([C@H]4N(C)C[C@H](CCC)C4)=O.Cl

InChI

InChI=1S/C26H39ClN2O6S.ClH/c1-6-7-15-12-18(29(3)13-15)24(31)28-19(14(2)27)21-23-22(20(30)26(35-21)36-5)33-25(34-23)16-8-10-17(32-4)11-9-16;/h8-11,14-15,18-23,25-26,30H,6-7,12-13H2,1-5H3,(H,28,31);1H/t14?,15-,18+,19?,20-,21-,22-,23+,25?,26-;/m1./s1

IUPAC

(2S,4R)-N-(2-chloro-1-((3aS,4R,6R,7R,7aR)-7-hydroxy-2-(4-methoxyphenyl)-6-(methylthio)tetrahydro-4H-[1,3]dioxolo[4,5-c]pyran-4-yl)propyl)-1-methyl-4-propylpyrrolidine-2-carboxamide hydrochloride

Alternate CAS Number

25908-42-3

Product Data

Storage Temperature

-20°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat

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