Cephabacin M6

Base Information

• Chemical Name: Cephabacin M6
• CAS No.: 99313-73-2
• Molecular Formula: C47H79N13O18S
• Molecular Weight: 1146.2715

Synonyms:Cephabacin M6;Cephabacin M(sub 6);99313-73-2;L-Valinamide, L-alanyl-L-seryl-L-ornithyl-L-valyl-L-ornithyl-N-(4-((7-((5-amino-5-carboxyl-1-oxopentyl)amino)-2-carboxy-7-methoxy-8-oxo-5-thia-1-azabicyclo(4.2.0)oct-3-en-3-yl)methoxy)-1-(2-amino-2-oxoethyl)-2-hydroxy-4-oxobutyl)-, (6R-(6-alpha,7-alpha,7(R*)))-;7-(5-amino-5-carboxypentanamido)-3-(24-amino-6-(2-amino-2-oxoethyl)-12,18-bis(3-aminopropyl)-5-hydroxy-21-(hydroxymethyl)-9,15-diisopropyl-3,8,11,14,17,20,23-heptaoxo-2-oxa-7,10,13,16,19,22-hexaazapentacosyl)-7-methoxy-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid;C47H79N13O18S;C47-H79-N13-O18-S;AKOS040746685;LS-161269;3-[[6-amino-4-[[2-[[5-amino-2-[[2-[[5-amino-2-[[2-(2-aminopropanoylamino)-3-hydroxypropanoyl]amino]pentanoyl]amino]-3-methylbutanoyl]amino]pentanoyl]amino]-3-methylbutanoyl]amino]-3-hydroxy-6-oxohexanoyl]oxymethyl]-7-[(5-amino-5-carboxypentanoyl)amino]-7-methoxy-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid

Chemical Property of Cephabacin M6

Chemical Property:

• Vapor Pressure: 0mmHg at 25°C
• Boiling Point: 1584.3°Cat760mmHg
• Flash Point: 911.9°C
• PSA: 572.49000
• Density: 1.42g/cm³
• LogP: 3.25990
• XLogP3: -11.3
• Hydrogen Bond Donor Count: 16
• Hydrogen Bond Acceptor Count: 23
• Rotatable Bond Count: 37
• Exact Mass: 1145.53867390
• Heavy Atom Count: 79
• Complexity: 2260

Purity/Quality:

95% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)C(C(=O)NC(CCCN)C(=O)NC(C(C)C)C(=O)NC(CC(=O)N)C(CC(=O)OCC1=C(N2C(C(C2=O)(NC(=O)CCCC(C(=O)O)N)OC)SC1)C(=O)O)O)NC(=O)C(CCCN)NC(=O)C(CO)NC(=O)C(C)N

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