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Product Overview

Product Code

TRC-R508043

Product Format

Neat

Molecular Formula

C43 D4 H54 N4 O12

Molecular Weight

826.965

API Family

Rifampicin-d4

Product Categories

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

Product Type

Stable Isotope Labelled, API, Contaminant

Unlabelled CAS Number

13292-46-1

Purity

>95% (HPLC)

Documentation

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Product Information

Chemical Data

Analyte Name

Rifampicin-d4

Molecular Formula

C43 D4 H54 N4 O12

Molecular Weight

826.965

Accurate Mass

826.43

SMILES

[2H]C1([2H])CN(C)CC([2H])([2H])N1\N=C\c2c(O)c3c4C(=O)[C@@]5(C)OC=C[C@H](OC)[C@@H](C)[C@@H](OC(=O)C)[C@H](C)[C@H](O)[C@H](C)[C@@H](O)[C@@H](C)\C=C\C=C(\C)/C(=O)Nc2c(O)c3c(O)c(C)c4O5

InChI

InChI=1S/C43H58N4O12/c1-21-12-11-13-22(2)42(55)45-33-28(20-44-47-17-15-46(9)16-18-47)37(52)30-31(38(33)53)36(51)26(6)40-32(30)41(54)43(8,59-40)57-19-14-29(56-10)23(3)39(58-27(7)48)25(5)35(50)24(4)34(21)49/h11-14,19-21,23-25,29,34-35,39,49-53H,15-18H2,1-10H3,(H,45,55)/b12-11+,19-14?,22-13-,44-20+/t21-,23+,24+,25+,29-,34-,35+,39+,43-/m0/s1/i17D2,18D2

IUPAC

[(7S,11S,12R,13S,14R,15R,16R,17S,18S,19E,21Z)-2,15,17,27,29-pentahydroxy-11-methoxy-3,7,12,14,16,18,22-heptamethyl-6,23-dioxo-26-[(E)-(2,2,6,6-tetradeuterio-4-methylpiperazin-1-yl)iminomethyl]-8,30-dioxa-24-azatetracyclo[23.3.1.14,7.05,28]triaconta-1,3,5(28),9,19,21,25(29),26-octaen-13-yl] acetate

Unlabelled CAS Number

13292-46-1

SIL Type

Deuterium

Product Data

Storage Temperature

-20°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat

API Family

Rifampicin-d4

Purity

>95% (HPLC)

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