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Substance Name: Allopregnane-3beta,17alpha,20beta,21-tetrol 3,20,21-triacetate
RN: 6199-84-4
UNII: OX57AK1732
InChIKey: CZWCJGAMABAMRM-UKCFDWNUSA-N

Molecular Formula

  • C27-H42-O7

Molecular Weight

  • 478.6218
 
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Names and Synonyms

Name of Substance

  • Allopregnane-3beta,17alpha,20beta,21-tetrol 3,20,21-triacetate

Synonyms

  • 5alpha-Pregnane-3beta,17,20beta,21-tetrol, 3,20,21-triacetate
  • Allopregnane-3beta,17alpha,20beta,21-tetrol 3,20,21-triacetate
  • Allopregnane-3beta,17alpha,20beta,21-tetrol triacetate [MI]
  • Pregnane-3,17,20,21-tetrol, 3,20,21-triacetate, (3beta,5alpha,20R)-
  • UNII-OX57AK1732

Registry Numbers

CAS Registry Number

  • 6199-84-4

FDA UNII

  • OX57AK1732

System Generated Number

  • 0006199844

Structure Descriptors

InChI

1S/C27H42O7/c1-16(28)32-15-24(34-18(3)30)27(31)13-10-23-21-7-6-19-14-20(33-17(2)29)8-11-25(19,4)22(21)9-12-26(23,27)5/h19-24,31H,6-15H2,1-5H3/t19-,20-,21+,22-,23-,24+,25-,26-,27-/m0/s1

InChIKey

CZWCJGAMABAMRM-UKCFDWNUSA-N

Smiles

CC(=O)OC[C@H]([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)OC(=O)C