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Substance Name: 21-Deoxytetrahydroaldosterone
RN: 6251-70-3
InChIKey: PLHRGCFLRHONCI-UELVEZJDSA-N

Note

  • Used in diagnosis of primary aldosteronism.

Molecular Formula

  • C21-H32-O4

Molecular Weight

  • 348.48
 
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Names and Synonyms

Name of Substance

  • 21-Deoxytetrahydroaldosterone

Synonym

  • 3,18-Dihydroxy-11,18-epoxy-pregnan-20-one

Systematic Name

  • Pregnan-20-one, 11,18-epoxy-3,18-dihydroxy-, (3alpha,5beta,11beta)-

Registry Numbers

CAS Registry Number

  • 6251-70-3

System Generated Number

  • 0006251703

Structure Descriptors

InChI

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

InChIKey

PLHRGCFLRHONCI-UELVEZJDSA-N

Smiles

C1[C@H](C[C@H]2CC[C@H]3[C@@H]4CC[C@@H](C(C)=O)[C@@]54[C@@H](O)O[C@H](C5)[C@H]3[C@@]2(C1)C)O