antibioticPS8
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antibioticPS8
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CAS No:
82837-65-8
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Formula:
C14H18N2O4S
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Chemical Name:
antibioticPS8
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Synonyms:
1-Azabicyclo(3.2.0)hept-2-ene-2-carboxylic acid, 3-((2-(acetylamino)ethenyl)thio)-6-(1-methylethyl)-7-oxo-;antibiotic PS 8;PS-8;3-[(E)-2-acetamidoethenyl]sulfanyl-7-oxo-6-propan-2-yl-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid
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CAS No:
Drug Information
1-Azabicyclo(3.2.0)hept-2-ene-2-carboxylic acid, 3-((2-(acetylamino)ethenyl)thio)-6-(1-methylethyl)-7-oxo-
Computed Properties
Molecular Weight:310.37
XLogP3:0.6
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:5
Exact Mass:310.09872823
Monoisotopic Mass:310.09872823
Topological Polar Surface Area:112
Heavy Atom Count:21
Complexity:553
Undefined Atom Stereocenter Count:2
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes