Desacetylcephapirin
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Desacetylcephapirin
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CAS No:
38115-21-8
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Formula:
C15H15N3O5S2
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Chemical Name:
Desacetylcephapirin
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Synonyms:
5-Thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid,3-(hydroxymethyl)-8-oxo-7-[[2-(4-pyridinylthio)acetyl]amino]-,(6R,7R)-;5-Thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid,3-(hydroxymethyl)-8-oxo-7-[[(4-pyridinylthio)acetyl]amino]-,(6R-trans)-;5-Thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid,3-(hydroxymethyl)-8-oxo-7-[[(4-pyridinylthio)acetyl]amino]-,(6R,7R)-;(6R,7R)-3-(Hydroxymethyl)-8-oxo-7-[[2-(4-pyridinylthio)acetyl]amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid;Desacetylcephapirin;Deacetylcephapirin
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CAS No:
Drug Information
3-(hydroxymethyl)-8-oxo-7-((2-(4-pyridylthio)acetyl)amino)-5-thia-1-azabicyclo(4.2.0)oct-2-ene-carboxylic acid
Computed Properties
Molecular Weight:381.4
XLogP3:-1.7
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:6
Exact Mass:381.04531293
Monoisotopic Mass:381.04531293
Topological Polar Surface Area:170
Heavy Atom Count:25
Complexity:606
Defined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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