Capreomycin IA - CAS 37280-35-6

Capreomycin IA is an antibiotic which is given in combination with other antibiotics for the treatment of tuberculosis. Specifically it is a second line treatment used for active drug resistant tuberculosis. It is given by injection into a vein or muscle.

Catalog Number: I024025

CAS Number: 37280-35-6

Molecular Formula: C25H44N14O8

Molecular Weight:668.72

Purity: 98.0%

Appearance:Solid powder

* For research use only. Not for human or veterinary use.

Synonym

SynonymsCapreomycin IA; A250-II; A 250-II; A-250-II

Property

Molecular Formula: C25H44N14O8
Molecular Weight668.72
SolubilitySoluble in DMSO
Purity98.0%
StorageDry, dark and at 0 - 4 C for short term (days to weeks) or -20 C for long term (months to years).

Computed Descriptor

IUPAC Name(S)-3,6-diamino-N-(((2S,5S,11S,15S,Z)-15-amino-2-(hydroxymethyl)-11-((R)-2-iminohexahydropyrimidin-4-yl)-3,6,9,12,16-pentaoxo-8-(ureidomethylene)-1,4,7,10,13-pentaazacyclohexadecan-5-yl)methyl)hexanamide
InChIInChI=1S/C25H44N14O8/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/h9,11-14,16,18,40H,1-8,10,26-28H2,(H,32,41)(H,33,46)(H,35,43)(H,36,45)(H,37,42)(H,39,44)(H3,29,31,38)(H3,30,34,47)/b15-9-/t11-,12-,13+,14-,16-,18-/m0/s1
InChIKeyJNIIDKODPGHQSS-MPSMQSNBSA-N
SMILESNCCC[C@@H](CC(NC[C@@H]1NC([C@@H](NC([C@H](CNC([C@H]([C@H]2CCNC(N2)=N)NC(/C(NC1=O)=C/NC(N)=O)=O)=O)N)=O)CO)=O)=O)N