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Substance Name: 3alpha,21-Dihydroxy-5beta-pregnane-11,20-dione
RN: 566-03-0
InChIKey: XWYBFXIUISNTQG-RHBMFIQRSA-N

Molecular Formula

  • C21-H32-O4

Molecular Weight

  • 348.4798
 
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Names and Synonyms

Synonym

  • EINECS 209-295-2

Systematic Name

  • 3alpha,21-Dihydroxy-5beta-pregnane-11,20-dione

Registry Numbers

CAS Registry Number

  • 566-03-0

System Generated Number

  • 0000566030

Structure Descriptors

InChI

1S/C21H32O4/c1-20-8-7-13(23)9-12(20)3-4-14-15-5-6-16(18(25)11-22)21(15,2)10-17(24)19(14)20/h12-16,19,22-23H,3-11H2,1-2H3/t12-,13-,14+,15+,16-,19-,20+,21+/m1/s1

InChIKey

XWYBFXIUISNTQG-RHBMFIQRSA-N

Smiles

C[C@]12CC[C@H](C[C@H]1CC[C@@H]3[C@@H]2C(=O)C[C@]4([C@H]3CC[C@@H]4C(=O)CO)C)O