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Substance Name: Allopregnan-20alpha-ol-3-one acetate
RN: 6010-88-4
UNII: 1K7TA6AS47
InChIKey: OCALFWPYWJWRRG-DXPSHRSCSA-N

Molecular Formula

  • C23-H36-O3

Molecular Weight

  • 360.5344
 
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Names and Synonyms

Name of Substance

  • Allopregnan-20alpha-ol-3-one acetate

Synonyms

  • Allopregnan-20alpha-ol-3-one acetate
  • Allopregnan-20alpha-ol-3-one acetate [MI]
  • Pregnan-3-one, 20-hydroxy-, (5alpha,20R)-
  • UNII-1K7TA6AS47

Registry Numbers

CAS Registry Number

  • 6010-88-4

FDA UNII

  • 1K7TA6AS47

System Generated Number

  • 0006010884

Structure Descriptors

InChI

1S/C23H36O3/c1-14(26-15(2)24)19-7-8-20-18-6-5-16-13-17(25)9-11-22(16,3)21(18)10-12-23(19,20)4/h14,16,18-21H,5-13H2,1-4H3/t14-,16-,18-,19+,20-,21-,22-,23+/m0/s1

InChIKey

OCALFWPYWJWRRG-DXPSHRSCSA-N

Smiles

C[C@@H]([C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC[C@@H]4[C@@]3(CCC(=O)C4)C)C)OC(=O)C