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Substance Name: 5beta-Pregnane-3alpha,17alpha,20alpha,21-tetrol
RN: 3615-89-2
InChIKey: MQSSTQLJJOVNQF-YAWPOEEYSA-N

Molecular Formula

  • C21-H36-O4

Molecular Weight

  • 352.511
 
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Names and Synonyms

Name of Substance

  • 5beta-Pregnane-3alpha,17alpha,20alpha,21-tetrol

Synonyms

  • 20alpha-Hexahydro-reichstein's compound S
  • 5beta-Pregnane-3alpha,17alpha,20beta,21-tetrol

Systematic Names

  • (3alpha,5beta,20S)-Pregnane-3,17,20,21-tetrol
  • Pregnane-3,17,20,21-tetrol, (3alpha,5beta,20S)-

Registry Numbers

CAS Registry Number

  • 3615-89-2

System Generated Number

  • 0003615892

Structure Descriptors

InChI

1S/C21H36O4/c1-19-8-5-14(23)11-13(19)3-4-15-16(19)6-9-20(2)17(15)7-10-21(20,25)18(24)12-22/h13-18,22-25H,3-12H2,1-2H3/t13-,14-,15-,16+,17+,18+,19+,20+,21+/m1/s1

InChIKey

MQSSTQLJJOVNQF-YAWPOEEYSA-N

Smiles

C1[C@H](C[C@H]2CC[C@H]3[C@@H]4CC[C@@]([C@H](CO)O)([C@@]4(C)CC[C@H]3[C@@]2(C1)C)O)O