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Substance Name: Allopregnane-3alpha,11beta,17alpha,21-tetrol-20-one 3,21-diacetate
RN: 4004-70-0
UNII: 47150L7IUL
InChIKey: QGAODEALOJFHBD-UZMCWQCBSA-N

Molecular Formula

  • C25-H38-O7

Molecular Weight

  • 450.5682
 
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Names and Synonyms

Name of Substance

  • Allopregnane-3alpha,11beta,17alpha,21-tetrol-20-one 3,21-diacetate

Synonyms

  • Allopregnane-3alpha,11beta,17alpha,21-tetrol-20-one 3,21-diacetate
  • Allopregnane-3alpha,11beta,17alpha,21-tetrol-20-one 3,21-diacetate [MI]
  • Pregnan-20-one, 3,21-bis(acetyloxy)-11,17-dihydroxy-, (3alpha,5alpha,11beta)-
  • UNII-47150L7IUL

Registry Numbers

CAS Registry Number

  • 4004-70-0

FDA UNII

  • 47150L7IUL

System Generated Number

  • 0004004700

Structure Descriptors

InChI

1S/C25H38O7/c1-14(26)31-13-21(29)25(30)10-8-19-18-6-5-16-11-17(32-15(2)27)7-9-23(16,3)22(18)20(28)12-24(19,25)4/h16-20,22,28,30H,5-13H2,1-4H3/t16-,17+,18-,19-,20-,22+,23-,24-,25-/m0/s1

InChIKey

QGAODEALOJFHBD-UZMCWQCBSA-N

Smiles

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