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Substance Name: Benzylpenicilloic acid
RN: 13057-98-2
UNII: NKZ5D4610Z
InChIKey: HCYWNSXLUZRKJX-VYAYZGMFSA-N

Molecular Formula

  • C16-H20-N2-O5-S

Molecular Weight

  • 352.409
 
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Names and Synonyms

Name of Substance

  • Benzylpenicilloic acid

Synonyms

  • NSC 163084
  • UNII-NKZ5D4610Z

Systematic Name

  • 2-Thiazolidineacetic acid, 4-carboxy-5,5-dimethyl-alpha-((phenylacetyl)amino)-

Registry Numbers

CAS Registry Number

  • 13057-98-2

FDA UNII

  • NKZ5D4610Z

Other Registry Numbers

  • 16883-22-0
  • 493-39-0

System Generated Number

  • 0013057982

Structure Descriptors

InChI

1S/C16H20N2O5S/c1-16(2)12(15(22)23)18-13(24-16)11(14(20)21)17-10(19)8-9-6-4-3-5-7-9/h3-7,11-13,18H,8H2,1-2H3,(H,17,19)(H,20,21)(H,22,23)/t11-,12-,13?/m0/s1

InChIKey

HCYWNSXLUZRKJX-VYAYZGMFSA-N

Smiles

CC1(C)SC(N[C@H]1C(=O)O)[C@H](NC(=O)Cc2ccccc2)C(=O)O