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CAS RN 8068-28-8

NaNaNaNaNaH3CCH3ONHNHSOOOOHNH3COHONHNHSOOOONHNHOHNOHNSOOONHOHNSOOONHOCH3CH3NHOH3CCH3HNONHSOOONHOH3CHO

CAS RN 8068-28-8

IUPAC Name: pentasodium [(3-{3-hydroxy-2-[2-(6-methyloctanamido)-4-[(sulfonatomethyl)amino]butanamido]butanamido}-3-{[3-(1-hydroxyethyl)-12,15-bis(2-methylpropyl)-2,5,8,11,14,17,20-heptaoxo-6,9,18-tris({2-[(sulfonatomethyl)amino]ethyl})-1,4,7,10,13,16,19-heptaazacyclotricosan-21-yl]carbamoyl}propyl)amino]methanesulfonate
Synonyms: pentasodium colistimethate
Molecular Weight (g/mol): 1749.81
Molecular Formula: C58H105N16Na5O28S5
InChi Key: IQWHCHZFYPIVRV-UHFFFAOYNA-I
SMILES: [Na+].[Na+].[Na+].[Na+].[Na+].CCC(C)CCCCC(=O)NC(CCNCS([O-])(=O)=O)C(=O)NC(C(C)O)C(=O)NC(CCNCS([O-])(=O)=O)C(=O)NC1CCNC(=O)C(NC(=O)C(CCNCS([O-])(=O)=O)NC(=O)C(CCNCS([O-])(=O)=O)NC(=O)C(CC(C)C)NC(=O)C(CC(C)C)NC(=O)C(CCNCS([O-])(=O)=O)NC1=O)C(C)O
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Colistin sodium methanesulfonate, Thermo Scientific™

CAS: 8068-28-8 Molecular Formula: C58H105N16Na5O28S5 Molecular Weight (g/mol): 1749.811 MDL Number: MFCD00130824 InChI Key: IQWHCHZFYPIVRV-KLWRPAJRSA-I Synonym: Colimycin sodium methanesulfonate; Polymyxin E sodium methanesulfonate PubChem CID: 131668505 IUPAC Name: pentasodium;(6S)-N-[(2R)-1-[[(2R,3S)-3-hydroxy-1-[[(2S)-1-[[(3S,6S,9S,12S,15R,18S,21S)-3-[(1R)-1-hydroxyethyl]-12,15-bis(2-methylpropyl)-8,17,20-trioxido-2,5,11,14-tetraoxo-6,9,18-tris[2-(sulfomethylamino)ethyl]-1,4,7,10,13,16,19-heptazacyclotricosa-7,16, SMILES: CCC(C)CCCCC(=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(N=C1[O-])CCNCS(=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+]

PubChem CID 131668505
CAS 8068-28-8
Molecular Weight (g/mol) 1749.811
MDL Number MFCD00130824
SMILES CCC(C)CCCCC(=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(N=C1[O-])CCNCS(=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+]
Synonym Colimycin sodium methanesulfonate; Polymyxin E sodium methanesulfonate
IUPAC Name pentasodium;(6S)-N-[(2R)-1-[[(2R,3S)-3-hydroxy-1-[[(2S)-1-[[(3S,6S,9S,12S,15R,18S,21S)-3-[(1R)-1-hydroxyethyl]-12,15-bis(2-methylpropyl)-8,17,20-trioxido-2,5,11,14-tetraoxo-6,9,18-tris[2-(sulfomethylamino)ethyl]-1,4,7,10,13,16,19-heptazacyclotricosa-7,16,
InChI Key IQWHCHZFYPIVRV-KLWRPAJRSA-I
Molecular Formula C58H105N16Na5O28S5