4-Thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid, 3,3-dimethyl-7-oxo-6-[(phenylacetyl)amino]- (2S,5R,6R)-, compd. with (αR,βS)-β-(methylamino)-α-phenylbenzeneethanol (1:1)
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![4-Thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid, 3,3-dimethyl-7-oxo-6-[(phenylacetyl)amino]- (2S,5R,6R)-, compd. with (αR,βS)-β-(methylamino)-α-phenylbenzeneethanol (1:1) structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/415e1b27c1e441f6b7504b4e7161535e.png "4-Thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid, 3,3-dimethyl-7-oxo-6-[(phenylacetyl)amino]- (2S,5R,6R)-, compd. with (αR,βS)-β-(methylamino)-α-phenylbenzeneethanol (1:1)")
4-Thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid, 3,3-dimethyl-7-oxo-6-[(phenylacetyl)amino]- (2S,5R,6R)-, compd. with (αR,βS)-β-(methylamino)-α-phenylbenzeneethanol (1:1)
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CAS No:
7177-43-7
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Formula:
C16H18N2O4S.C15H17NO
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Chemical Name:
4-Thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid, 3,3-dimethyl-7-oxo-6-[(phenylacetyl)amino]- (2S,5R,6R)-, compd. with (αR,βS)-β-(methylamino)-α-phenylbenzeneethanol (1:1)
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Synonyms:
4-Thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,3,3-dimethyl-7-oxo-6-[(phenylacetyl)amino]- (2S,5R,6R)-,compd. with (αR,βS)-β-(methylamino)-α-phenylbenzeneethanol (1:1);4-Thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,3,3-dimethyl-7-oxo-6-(2-phenylacetamido)-,compd. with (-)-2-(methylamino)-1,2-diphenylethanol (1:1);4-Thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,3,3-dimethyl-7-oxo-6-[(phenylacetyl)amino]- [2S-(2α,5α,6β)]-,compd. with [R-(R*,S*)]-β-(methylamino)-α-phenylbenzeneethanol (1:1);Benzeneethanol,β-(methylamino)-α-phenyl-,[R-(R*,S*)]-,[2S-(2α,5α,6β)]-3,3-dimethyl-7-oxo-6-[(phenylacetyl)amino]-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate (salt);Benzeneethanol,β-(methylamino)-α-phenyl-,(αR,βS)-,(2S,5R,6R)-3,3-dimethyl-7-oxo-6-[(phenylacetyl)amino]-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate (salt);(-)-Ephenamine penicillin G;l-Ephenamine penicillin G;Penicillin G (-)-ephenamine salt;Ephenamine penicillin;Compenamine
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CAS No:
4-Thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid, 3,3-dimethyl-7-oxo-6-[(phenylacetyl)amino]- (2S,5R,6R)-, compd. with (αR,βS)-β-(methylamino)-α-phenylbenzeneethanol (1:1) Basic Attributes
561.7 g/mol
561.22974240 g/mol
230-537-8
Computed Properties
Molecular Weight:561.7
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:8
Exact Mass:561.22974240
Monoisotopic Mass:561.22974240
Topological Polar Surface Area:144
Heavy Atom Count:40
Complexity:737
Defined Atom Stereocenter Count:3
Undefined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:2
Compound Is Canonicalized:Yes
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