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Substance Name: Cicloxolone disodium
RN: 61435-39-0
UNII: 7S0509075P
InChIKey: TYMKTTKIVJPCOT-OHDBHOPNSA-L

Molecular Formula

  • C38-H54-O7.2Na

Molecular Weight

  • 668.8176
 
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Names and Synonyms

Name of Substance

  • Cicloxolone disodium

Synonyms

  • BX 363A
  • BX-363A
  • Cicloxolone disodium
  • Olean-12-en-29-oic acid, 3-(((2-carboxycyclohexyl)carbonyl)oxy)-11-oxo-, disodium salt, (3beta,20beta)-
  • UNII-7S0509075P

Registry Numbers

CAS Registry Number

  • 61435-39-0

FDA UNII

  • 7S0509075P

System Generated Number

  • 0061435390

Structure Descriptors

InChI

1S/C38H56O7.2Na/c1-33(2)27-12-15-38(7)29(36(27,5)14-13-28(33)45-31(42)23-11-9-8-10-22(23)30(40)41)26(39)20-24-25-21-35(4,32(43)44)17-16-34(25,3)18-19-37(24,38)6;;/h20,22-23,25,27-29H,8-19,21H2,1-7H3,(H,40,41)(H,43,44);;/q;2*+1/p-2/t22?,23?,25-,27-,28-,29+,34+,35-,36-,37+,38+;;/m0../s1

InChIKey

TYMKTTKIVJPCOT-OHDBHOPNSA-L

Smiles

[Na+].[Na+].C[C@]12CC[C@@](C)(C[C@H]1C3=CC(=O)[C@@H]4[C@@]5(C)CC[C@H](OC(=O)C6CCCCC6C(=O)[O-])C(C)(C)[C@@H]5CC[C@@]4(C)[C@]3(C)CC2)C(=O)[O-]