Product Code

TRC-H948892

CAS Number

1315376-90-9

Product Format

Neat

Molecular Formula

C47 2H5 H46 N O15

Molecular Weight

874.94

API Family

Paclitaxel

Product Categories

TRC, Impurity Reference Materials , Stable isotopes, Stable Isotope Labelled Analytical Standards

Product Type

Stable Isotope Labelled, Impurity, Metabolite

Alternate CAS Number

153212-75-0

Unlabelled CAS Number

153212-75-0

Purity

>95% (HPLC)

Price and availability

48-hour USA dispatch time

Freight restricted.

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Product Information

Chemical Data

Analyte Name

6alpha-Hydroxy Paclitaxel benzoylamino-d5

CAS Number

1315376-90-9

Molecular Formula

C47 2H5 H46 N O15

Molecular Weight

874.94

Accurate Mass

874.3573

SMILES

[2H]c1c([2H])c([2H])c(C(=O)N[C@H]([C@@H](O)C(=O)O[C@H]2C[C@@]3(O)[C@@H](OC(=O)c4ccccc4)[C@@H]5[C@@]6(CO[C@@H]6[C@@H](O)[C@H](O)[C@@]5(C)C(=O)[C@H](OC(=O)C)C(=C2C)C3(C)C)OC(=O)C)c7ccccc7)c([2H])c1[2H]

InChI

InChI=1S/C47H51NO15/c1-24-30(61-43(57)33(51)32(27-16-10-7-11-17-27)48-41(55)28-18-12-8-13-19-28)22-47(58)40(62-42(56)29-20-14-9-15-21-29)36-45(6,38(54)35(60-25(2)49)31(24)44(47,4)5)37(53)34(52)39-46(36,23-59-39)63-26(3)50/h7-21,30,32-37,39-40,51-53,58H,22-23H2,1-6H3,(H,48,55)/t30-,32-,33+,34-,35+,36-,37-,39+,40-,45-,46+,47+/m0/s1/i8D,12D,13D,18D,19D

Alternate CAS Number

153212-75-0

Unlabelled CAS Number

153212-75-0

SIL Type

Deuterium

Product Data

Storage Temperature

-20°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Type

Metabolite; Stable Isotope Labelled

Product Format

Neat

API Family

Paclitaxel

Purity

>95% (HPLC)

Product Description

The major human labelled metabolite of Paclitaxel.

References: Monsarrat, B., et al.: Drug Metab. Dispos., 18, 895 (1990), Walle, T., et al.: Biochem. Pharm., 46, 1661 (1993), Harris, J., et al.: J. Med. Chem., 37, 706 (1994),

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6alpha-Hydroxy Paclitaxel-d5 (~90%)

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