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CAS 24593-54-2

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4-Thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid, 6-[[amino(3-chloro-4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-, [2S-[2α,5α,6β(S*)]]-

Description:
4-Thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid, with the CAS number 24593-54-2, is a complex organic compound characterized by its bicyclic structure that incorporates both sulfur and nitrogen atoms. This compound features a carboxylic acid functional group, which contributes to its acidity and potential reactivity. The presence of an amino group and a chloro-substituted phenyl ring suggests that it may exhibit biological activity, possibly as a pharmaceutical agent. The specific stereochemistry indicated by the [2S-[2α,5α,6β(S*)]] notation implies that the molecule has defined spatial arrangements, which can significantly influence its interactions with biological targets. Additionally, the presence of a ketone group (7-oxo) and dimethyl substituents further adds to its structural complexity. Overall, this compound's unique features may render it of interest in medicinal chemistry, particularly in the development of new therapeutic agents. However, detailed studies would be necessary to fully understand its properties and potential applications.
Formula:C16H18ClN3O5S
InChI:InChI=1S/C16H18ClN3O5S/c1-16(2)11(15(24)25)20-13(23)10(14(20)26-16)19-12(22)9(18)6-3-4-8(21)7(17)5-6/h3-5,9-11,14,21H,18H2,1-2H3,(H,19,22)(H,24,25)/t9-,10-,11+,14-/m1/s1
InChI key:InChIKey=YYQJMWQAYJIJED-NJBDSQKTSA-N
SMILES:C(O)(=O)[C@@H]1N2[C@@]([C@H](NC([C@H](N)C3=CC(Cl)=C(O)C=C3)=O)C2=O)(SC1(C)C)[H]
Synonyms:
  • m-Chloro-p-hydroxyampicillin
  • 4-Thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid, 6-[2-amino-2-(3-chloro-4-hydroxyphenyl)acetamido]-3,3-dimethyl-7-oxo-, D-
  • 4-Thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid, 6-[[amino(3-chloro-4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-, [2S-[2α,5α,6β(S*)]]-
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