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Substance Name: 14-alpha,17-alpha,21-Trihydroxypregn-4-ene-3,20-dione
RN: 595-18-6
InChIKey: NBOPGWCQYLBUPH-FHBGEGHHSA-N

Molecular Formula

  • C21-H30-O5

Molecular Weight

  • 362.463
 
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Names and Synonyms

Synonym

  • EINECS 209-858-2

Systematic Name

  • 14-alpha,17-alpha,21-Trihydroxypregn-4-ene-3,20-dione

Registry Numbers

CAS Registry Number

  • 595-18-6

System Generated Number

  • 0000595186

Structure Descriptors

InChI

1S/C21H30O5/c1-18-7-5-14(23)11-13(18)3-4-16-15(18)6-8-19(2)20(16,25)9-10-21(19,26)17(24)12-22/h11,15-16,22,25-26H,3-10,12H2,1-2H3/t15-,16+,18-,19-,20+,21-/m0/s1

InChIKey

NBOPGWCQYLBUPH-FHBGEGHHSA-N

Smiles

C=12[C@@]([C@H]3CC[C@@]4([C@@](C(=O)CO)(CC[C@@]4([C@@H]3CC2)O)O)C)(CCC(C1)=O)C