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Substance Name: Allopregnane-3beta,17alpha-diol-20-one 3-acetate
RN: 5456-44-0
UNII: X12IGG0Y3F
InChIKey: TVQDBRRFOFGWDS-LQHFQCQCSA-N

Molecular Formula

  • C23-H36-O4

Molecular Weight

  • 376.5334
 
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Names and Synonyms

Name of Substance

  • Allopregnane-3beta,17alpha-diol-20-one 3-acetate

Synonyms

  • Allopregnane-3beta,17alpha-diol-20-one 3-acetate
  • Allopregnane-3beta,17alpha-diol-20-one 3-acetate [MI]
  • NSC-15480
  • NSC-8106
  • Pregnan-20-one, 3-(acetyloxy)-17-hydroxy-, (3beta,5alpha)-
  • UNII-X12IGG0Y3F

Registry Numbers

CAS Registry Number

  • 5456-44-0

FDA UNII

  • X12IGG0Y3F

System Generated Number

  • 0005456440

Structure Descriptors

InChI

1S/C23H36O4/c1-14(24)23(26)12-9-20-18-6-5-16-13-17(27-15(2)25)7-10-21(16,3)19(18)8-11-22(20,23)4/h16-20,26H,5-13H2,1-4H3/t16-,17-,18+,19-,20-,21-,22-,23-/m0/s1

InChIKey

TVQDBRRFOFGWDS-LQHFQCQCSA-N

Smiles

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