Chemical Compound

Colistimethate sodium

CAS Registry Number 30387-39-4
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Colistimethate sodium chemical structure
Primary Record

Colistimethate sodium

In stock
1,170 g
Purity
99.8 %
CAS
30387-39-4

Compound Identifiers & Properties

CAS
30387-39-4
PubChem CID
137321142
SMILES
CCC(C)CCCC(=NC(CCNCS(=O)(=O)O)C(=O)NC(C(C)O)C(=O)NC(CCNCS(=O)(=O)O)C(=NC1CCNC(=O)C(NC(=O)C(N=C(C(NC(=O)C(NC(=O)C(N=C(C(CCN=C1[O-])NCS(=O)(=O)O)[O-])CC(C)C)CC(C)C)CCNCS(=O)(=O)O)[O-])CCNCS(=O)(=O)O)C(C)O)[O-])[O-].[Na+].[Na+].[Na+].[Na+].[Na+]
Canonical SMILES
CCC(C)CCCC([O-])=NC(CCNCS(=O)(=O)O)C(=O)NC(C(=O)NC(CCNCS(=O)(=O)O)C([O-])=NC1CCNC(=O)C(C(C)O)NC(=O)C(CCNCS(=O)(=O)O)N=C([O-])C(CCNCS(=O)(=O)O)NC(=O)C(CC(C)C)NC(=O)C(CC(C)C)N=C([O-])C(NCS(=O)(=O)O)CCN=C1[O-])C(C)O.[Na+].[Na+].[Na+].[Na+].[Na+]

Names & Synonyms

  • Colistimethate sodium
  • KTSAXLCYYZSLAY-UHFFFAOYSA-I
  • C57H103N16Na5O28S5
  • MFCD31707668
  • 30387-39-4
  • 8068-28-8
  • pentasodium;[2-[3-(1-hydroxyethyl)-23-[[2-[[3-hydroxy-2-[[2-(5-methylheptanoylamino)-4-(sulfonatomethylamino)butanoyl]amino]butanoyl]amino]-4-(sulfonatomethylamino)butanoyl]amino]-12,15-diisobutyl-2,5,8,11,14,17,22-heptaoxo-18-(sulfonatomethylamino)-9-[2-(sulfonatomethylamino)ethyl]-1,4,7,10,13,16,21-heptazacyclopentacos-6-yl]ethylamino]methanesulfonate