2,2-dimethylpropanoyloxymethyl (6R,7R)-3-ethenyl-8-oxo-7-[(2-phenylacetyl)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
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![2,2-dimethylpropanoyloxymethyl (6R,7R)-3-ethenyl-8-oxo-7-[(2-phenylacetyl)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/88d18d2ede9d4d3ead9247ded993d39c.png "2,2-dimethylpropanoyloxymethyl (6R,7R)-3-ethenyl-8-oxo-7-[(2-phenylacetyl)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate")
2,2-dimethylpropanoyloxymethyl (6R,7R)-3-ethenyl-8-oxo-7-[(2-phenylacetyl)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
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CAS No:
146383-05-3
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Formula:
C23H26N2O6S
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Chemical Name:
2,2-dimethylpropanoyloxymethyl (6R,7R)-3-ethenyl-8-oxo-7-[(2-phenylacetyl)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
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Synonyms:
pivaloyloxymethyl 7-phenylacetamido-3-vinyl-3-cephem-4-carboxylate;POM-PAVCC;Pom-pavcc;146383-05-3;Pivaloyloxymethyl 7-phenylacetamido-3-vinyl-3-cephem-4-carboxylate;DTXSID80163364;5-Thia-1-azabicyclo(4.2.0)oct-2-ene-2-carboxylic acid, 3-ethenyl-8-oxo-7-((phenylacetyl)amino)-, (2,2-dimethyl-1-oxopropoxy)methyl ester, (6R-trans)-
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CAS No:
2,2-dimethylpropanoyloxymethyl (6R,7R)-3-ethenyl-8-oxo-7-[(2-phenylacetyl)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Basic Attributes
458.5 g/mol
458.15115773 g/mol
DTXSID80163364
Computed Properties
Molecular Weight:458.5
XLogP3:3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:10
Exact Mass:458.15115773
Monoisotopic Mass:458.15115773
Topological Polar Surface Area:127
Heavy Atom Count:32
Complexity:825
Defined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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