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Product Overview

Product Code

TRC-D288722

Product Format

Neat

Molecular Formula

C45H54D8N4O11

Molecular Weight

843.04

API Family

Rifapentine

Product Categories

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

Product Type

Stable Isotope Labelled, Metabolite

Alternate CAS Number

79039-56-8

Unlabelled CAS Number

79039-56-8

Documentation

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Product Information

Chemical Data

Analyte Name

25-Desacetyl Rifapentin-d8

Molecular Formula

C45H54D8N4O11

Molecular Weight

843.04

SMILES

O=C(/C(C)=C\C=C\[C@H](C)[C@H](O)[C@@H](C)[C@@H](O)[C@@H](C)[C@H](O)[C@H](C)[C@@H](OC)/C=C/O[C@@](C1=O)(C)O2)NC3=C(O)C4=C(O)C(C)=C2C1=C4C(O)=C3C=NN5C([2H])([2H])C([2H])([2H])N(C6CCCC6)C([2H])([2H])C5([2H])[2H]

InChI

InChI=1S/C45H62N4O11/c1-23-12-11-13-24(2)44(57)47-35-30(22-46-49-19-17-48(18-20-49)29-14-9-10-15-29)40(54)32-33(41(35)55)39(53)28(6)42-34(32)43(56)45(7,60-42)59-21-16-31(58-8)25(3)37(51)27(5)38(52)26(4)36(23)50/h11-13,16,21-23,25-27,29,31,36-38,50-55H,9-10,14-15,17-20H2,1-8H3,(H,47,57)/b12-11+,21-16+,24-13-,46-22?/t23-,25+,26+,27-,31-,36-,37+,38+,45-/m0/s1/i17D2,18D2,19D2,20D2

Alternate CAS Number

79039-56-8

Unlabelled CAS Number

79039-56-8

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

Rifapentine

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Product Overview

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Chemical Data

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