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Product Overview

Product Code

TRC-I937550

Product Format

Neat

Molecular Formula

C35H38Cl2N8O4

Molecular Weight

705.63

Product Categories

TRC, Antimycotics, Forensic and Toxicology Reference Materials, Other antifungals, Antifungals, Pharmaceutical Toxicology Reference Materials

Alternate CAS Number

Mixture: 848585-68-2 + 848585-69-3

Drug Type

Antifungals

Product Information

Chemical Data

Analyte Name

(2R,4R)-Itraconazole (Mixture of Diastereomers)

Molecular Formula

C35H38Cl2N8O4

Molecular Weight

705.63

SMILES

O=C1N(C(C)CC)N=CN1C(C=C2)=CC=C2N(CC3)CCN3C4=CC=C(OC[C@H]5O[C@@](CN6N=CN=C6)(C7=CC=C(Cl)C=C7Cl)OC5)C=C4

InChI

InChI=1S/C35H38Cl2N8O4/c1-3-25(2)45-34(46)44(24-40-45)29-7-5-27(6-8-29)41-14-16-42(17-15-41)28-9-11-30(12-10-28)47-19-31-20-48-35(49-31,21-43-23-38-22-39-43)32-13-4-26(36)18-33(32)37/h4-13,18,22-25,31H,3,14-17,19-21H2,1-2H3/t25?,31-,35+/m1/s1

Alternate CAS Number

Mixture: 848585-68-2 + 848585-69-3

Product Data

Storage Temperature

-20°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat

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