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Substance Name: Penicillin S
RN: 575-54-2
UNII: B9405MYY5G
InChIKey: ADIHZDIWDRJIOQ-JFGNBEQYSA-N

Molecular Formula

  • C14-H19-Cl-N2-O4-S2

Molecular Weight

  • 378.8991
 
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Names and Synonyms

Name of Substance

  • Penicillin S

Synonyms

  • (2S,5R,6R)-6-((((3-Chloro-2-butenyl)thio)acetyl)amino)-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo(3.2.0)heptane-2-carboxylic acid
  • 4-Thia-1-azabicyclo(3.2.0)heptane-2-carboxylic acid, 6-((2-((3-chloro-2-buten-1-yl)thio)acetyl)amino)-3,3-dimethyl-7-oxo-, (2S,5R,6R)-
  • gamma-Chlorocrotylmercaptomethylpenicillin
  • Penicillin S
  • Penicillin S [MI]
  • UNII-B9405MYY5G

Registry Numbers

CAS Registry Number

  • 575-54-2

FDA UNII

  • B9405MYY5G

System Generated Number

  • 0000575542

Structure Descriptors

InChI

1S/C14H19ClN2O4S2/c1-7(15)4-5-22-6-8(18)16-9-11(19)17-10(13(20)21)14(2,3)23-12(9)17/h4,9-10,12H,5-6H2,1-3H3,(H,16,18)(H,20,21)/t9-,10+,12-/m1/s1

InChIKey

ADIHZDIWDRJIOQ-JFGNBEQYSA-N

Smiles

CC(=CCSCC(=O)N[C@H]1[C@H]2SC(C)(C)[C@@H](N2C1=O)C(=O)O)Cl