Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: Clometocillin [INN:DCF]
RN: 1926-49-4
UNII: YI8LL014GF
InChIKey: JKXQBIZCQJLVOS-GSNLGQFWSA-N

Molecular Formula

  • C17-H18-Cl2-N2-O5-S

Molecular Weight

  • 433.3102
 
* denotes mobile formatted website

Links to Resources

NLM Resources (File Locators)

Other Resources (Internet Locators)


Search for this InChIKey on the Web

Names and Synonyms

Name of Substance

  • Clometacillin
  • Clometocillin [INN:DCF]

Synonyms

  • (2S,5R,6R)-6-(2-(3,4-Dichlorphenyl)-2-methoxyacetamido)-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo(3.2.0)heptan-2-carbonsaeure
  • 3,4-Dichloro-alpha-methoxybenzylpenicillin
  • 6-(2-(3,4-Dichlorophenyl)-2-methoxyacetamido)-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo(3.2.0)heptane-2-carboxylic acid
  • Clometocilina
  • Clometocilina [INN-Spanish]
  • Clometocillin
  • Clometocilline
  • Clometocilline [INN-French]
  • Clometocillinum
  • Clometocillinum [INN-Latin]
  • EINECS 217-657-6
  • Penicilline 356
  • Rixapen
  • UNII-YI8LL014GF

Systematic Names

  • (3,4-Dichloro-alpha-methoxybenzyl)penicillin
  • Clometocillin

Registry Numbers

CAS Registry Number

  • 1926-49-4

FDA UNII

  • YI8LL014GF

System Generated Number

  • 0001926494

Structure Descriptors

InChI

1S/C17H18Cl2N2O5S/c1-17(2)12(16(24)25)21-14(23)10(15(21)27-17)20-13(22)11(26-3)7-4-5-8(18)9(19)6-7/h4-6,10-12,15H,1-3H3,(H,20,22)(H,24,25)/t10-,11?,12+,15-/m1/s1

InChIKey

JKXQBIZCQJLVOS-GSNLGQFWSA-N

Smiles

CC1([C@@H](N2[C@H](S1)[C@@H](C2=O)NC(=O)C(c3ccc(c(c3)Cl)Cl)OC)C(=O)O)C

Physical Properties

Physical Property Value Units Temp (deg C) Source
log P (octanol-water) 2.860 (none)   EST
Atmospheric OH Rate Constant 7.51E-11 cm3/molecule-sec 25 EST

Physical property data is provided to ChemIDplus by SRC, Inc.