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Product Overview

Product Code

TRC-C175675

CAS Number

1405-37-4

Product Format

Neat

Molecular Formula

C24H44N14O12S

Molecular Weight

752.8

API Family

Capreomycin Sulfate

Product Categories

TRC, Bioactive small molecules, API Reference Standards & Research Materials, Tuberculostatics, Pharmaceutical Toxicology Reference Materials

Product Type

API

Alternate CAS Number

Free base: 11003-38-6

Documentation

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Product Information

Chemical Data

Analyte Name

Capreomycin Sulfate

CAS Number

1405-37-4

Molecular Formula

C24H44N14O12S

Molecular Weight

752.8

SMILES

C1CN=C(NC1C2C(=O)NC[C@@H](C(=O)NC(C(=O)N[C@H](C(=O)N/C(=C\NC(=O)N)/C(=O)N2)CNC(=O)[C@H](CCCN)N)CO)N)N.OS(=O)(=O)O

InChI

InChI=1S/C25H44N14O8.H2O4S/c26-4-1-2-11(27)6-17(41)32-8-14-20(43)35-15(9-34-25(30)47)21(44)39-18(13-3-5-31-24(29)38-13)23(46)33-7-12(28)19(42)37-16(10-40)22(45)36-14;1-5(2,3)4/h5,9,11-14,16,18,24,38,40H,1-4,6-8,10,26-29H2,(H,32,41)(H,33,46)(H,35,43)(H,36,45)(H,37,42)(H,39,44)(H3,30,34,47);(H2,1,2,3,4)/b15-9-;/t11-,12?,13-,14-,16-,18?,24?;/m1./s1 andInChI=1S/C25H44N14O7/c1-11-19(41)36-15(9-32-17(40)7-12(27)3-2-5-26)21(43)37-16(10-34-25(30)46)22(44)39-18(14-4-6-31-24(29)38-14)23(45)33-8-13(28)20(42)35-11/h6,10-15,18,24,38H,2-5,7-9,26-29H2,1H3,(H,32,40)(H,33,45)(H,35,42)(H,36,41)(H,37,43)(H,39,44)(H3,30,34,46)/b16-10-/t11-,12-,13?,14-,15-,18?,24?/m1/s1

IUPAC

(3R)-3,6-diamino-N-(((2R,5R,Z)-15-amino-11-((4R)-2-amino-2,3,4,5-tetrahydropyrimidin-4-yl)-2-methyl-3,6,9,12,16-pentaoxo-8-(ureidomethylene)-1,4,7,10,13-pentaazacyclohexadecan-5-yl)methyl)hexanamide sulfuric acid and (3R)-3,6-diamino-N-(((2R,5R,Z)-15-amino-11-((4R)-2-amino-2,3,4,5-tetrahydropyrimidin-4-yl)-2-(hydroxymethyl)-3,6,9,12,16-pentaoxo-8-(ureidomethylene)-1,4,7,10,13-pentaazacyclohexadecan-5-yl)methyl)hexanamide Sulfuric acid salt

Alternate CAS Number

Free base: 11003-38-6

Product Data

Storage Temperature

+4°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Type

API

Product Format

Neat

API Family

Capreomycin Sulfate

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