Einecs 260-339-7
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Einecs 260-339-7
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CAS No:
56686-90-9
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Formula:
C27H36N4O13S2
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Chemical Name:
Einecs 260-339-7
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Synonyms:
5-Thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid,3-[[(aminocarbonyl)oxy]methyl]-7-methoxy-7-[[6-(methoxymethoxy)-5-[[(4-methylphenyl)sulfonyl]amino]-1,6-dioxohexyl]amino]-8-oxo-,methoxymethyl ester,[6R-[6α,7α,7(R*)]]-
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CAS No:
Computed Properties
Molecular Weight:688.7
XLogP3:0.5
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:15
Rotatable Bond Count:20
Exact Mass:688.17202956
Monoisotopic Mass:688.17202956
Topological Polar Surface Area:262
Heavy Atom Count:46
Complexity:1280
Defined Atom Stereocenter Count:2
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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