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Product Overview

Product Code

TRC-D494423

Product Format

Neat

Molecular Formula

C43 D5 H48 N O14

Molecular Weight

812.91

API Family

Paclitaxel, Docetaxel

Product Categories

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

Product Type

Stable Isotope Labelled, Bioactive Small Molecule, API

Alternate CAS Number

148408-66-6

Purity

>95% (HPLC)

Documentation

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Product Information

Chemical Data

Analyte Name

Docetaxel-d5

Molecular Formula

C43 D5 H48 N O14

Molecular Weight

812.91

Accurate Mass

812.378

SMILES

[2H]c1c([2H])c([2H])c(C(=O)O[C@H]2[C@@H]3[C@@]4(CO[C@@H]4C[C@H](O)[C@@]3(C)C(=O)[C@H](O)C5=C(C)[C@H](C[C@]2(O)C5(C)C)OC(=O)[C@H](O)[C@@H](NC(=O)OC(C)(C)C)c6ccccc6)OC(=O)C)c([2H])c1[2H]

InChI

InChI=1S/C43H53NO14/c1-22-26(55-37(51)32(48)30(24-15-11-9-12-16-24)44-38(52)58-39(3,4)5)20-43(53)35(56-36(50)25-17-13-10-14-18-25)33-41(8,34(49)31(47)29(22)40(43,6)7)27(46)19-28-42(33,21-54-28)57-23(2)45/h9-18,26-28,30-33,35,46-48,53H,19-21H2,1-8H3,(H,44,52)/t26-,27-,28+,30-,31+,32+,33-,35-,41+,42-,43+/m0/s1/i10D,13D,14D,17D,18D

Alternate CAS Number

148408-66-6

SIL Type

Deuterium

Product Data

Storage Temperature

-20°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Type

API; Stable Isotope Labelled

Product Format

Neat

API Family

Paclitaxel; Docetaxel

Purity

>95% (HPLC)

Product Description

A labelled semisynthetic derivative of Paclitaxel. An antimitotic agent that promotes the assembly of micro-tubules and inhibits their de-polymerization to free tubulin. An antineoplastic.

References: Ringel, I., et al.: J. Natl. Cancer Inst., 83, 288 (1991), Extra, J.-M., et al.: Cancer Res., 53, 1037 (1993)

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