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Substance Name: Penicillin G N-ethylpiperidine salt
RN: 39879-63-5
InChIKey: KLNSFLVJJKLEDK-LQDWTQKMSA-N

Molecular Formula

  • C16-H18-N2-O4-S.C7-H15-N

Molecular Weight

  • 447.5967
 
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Names and Synonyms

Name of Substance

  • Penicillin G N-ethylpiperidine salt

Synonyms

  • EINECS 254-670-6
  • N-Ethylpiperidine benzylpenicillanate

Systematic Name

  • (2S-(2alpha,5alpha,6beta))-3,3-Dimethyl-7-oxo-6-((phenylacetyl)amino)-4-thia-1-azabicyclo(3.2.0)heptane-2-carboxylic acid, compound with 1-ethylpiperidine (1:1)

Registry Numbers

CAS Registry Number

  • 39879-63-5

System Generated Number

  • 0039879635

Molecular Formulas

Molecular Formula

  • C16-H18-N2-O4-S.C7-H15-N

Molecular Formula Fragments

  • C16-H18-N2-O4-S
  • C7-H15-N
  • COMPONENT

Structure Descriptors

InChI

1S/C16H18N2O4S.C7H15N/c1-16(2)12(15(21)22)18-13(20)11(14(18)23-16)17-10(19)8-9-6-4-3-5-7-9;1-2-8-6-4-3-5-7-8/h3-7,11-12,14H,8H2,1-2H3,(H,17,19)(H,21,22);2-7H2,1H3/t11-,12+,14-;/m1./s1

InChIKey

KLNSFLVJJKLEDK-LQDWTQKMSA-N

Smiles

CCN1CCCCC1.CC1([C@@H](N2[C@H](S1)[C@@H](C2=O)NC(=O)Cc3ccccc3)C(=O)O)C