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Product Overview

Product Code

TRC-D198205

CAS Number

1416773-22-2

Product Format

Neat

Molecular Formula

C43H58N4O12

Molecular Weight

822.94

API Family

Rifampicin

Product Categories

Chiral Molecules , TRC, Impurity Reference Materials , Pharmaceutical Reference Standards, Antibiotics, Pharmaceutical Toxicology Reference Materials

Product Type

Impurity

Documentation

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Product Information

Chemical Data

Analyte Name

25-Deacetyl-21-acetyl Rifampicin

CAS Number

1416773-22-2

Molecular Formula

C43H58N4O12

Molecular Weight

822.94

Accurate Mass

822.4051

SMILES

CO[C@H]1\C=C\O[C@@]2(C)Oc3c(C)c(O)c4c(O)c(NC(=O)\C(=C/C=C/[C@H](C)[C@H](OC(=O)C)[C@@H](C)[C@@H](O)[C@@H](C)[C@H](O)[C@@H]1C)\C)c(\C=N\N5CCN(C)CC5)c(O)c4c3C2=O

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)34(49)24(4)35(50)25(5)39(21)58-27(7)48/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-/m1/s1

IUPAC

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

Product Data

Storage Temperature

-20°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Type

Impurity

Product Format

Neat

API Family

Rifampicin

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Product Overview

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Chemical Data

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25-Deacetyl-21-acetyl Rifampicin

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