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Substance Name: Clocortolone caproate
RN: 4891-71-8
UNII: 871M9PSU7T
InChIKey: MMTRTBFDFNRBQO-ANHDKODLSA-N

Molecular Formula

  • C28-H38-Cl-F-O5

Molecular Weight

  • 509.054
 
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Names and Synonyms

Name of Substance

  • Clocortolone caproate

Synonyms

  • EINECS 225-513-9
  • UNII-871M9PSU7T

Systematic Name

  • 9-Chloro-6alpha-fluoro-11beta,21-dihydroxy-16alpha-methylpregna-1,4-diene-3,20-dione 21-hexanoate

Registry Numbers

CAS Registry Number

  • 4891-71-8

FDA UNII

  • 871M9PSU7T

System Generated Number

  • 0004891718

Structure Descriptors

InChI

1S/C28H38ClFO5/c1-5-6-7-8-24(34)35-15-22(32)25-16(2)11-18-19-13-21(30)20-12-17(31)9-10-27(20,4)28(19,29)23(33)14-26(18,25)3/h9-10,12,16,18-19,21,23,25,33H,5-8,11,13-15H2,1-4H3/t16-,18+,19+,21+,23+,25-,26+,27+,28+/m1/s1

InChIKey

MMTRTBFDFNRBQO-ANHDKODLSA-N

Smiles

C1=2[C@@](C=CC(=O)C2)(C)[C@@]2([C@H]([C@@H]3C[C@@H](C)[C@@H]([C@@]3(C[C@@H]2O)C)C(COC(=O)CCCCC)=O)C[C@@H]1F)Cl