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Substance Name: Pregnanetriol
RN: 1098-45-9
UNII: 43822S61TB
InChIKey: SCPADBBISMMJAW-UHHUKTEYSA-N

Note

  • A metabolite of 17-ALPHA-HYDROXYPROGESTERONE, normally produced in small quantities by the GONADS and the ADRENAL GLANDS, found in URINE. An elevated urinary pregnanetriol is associated with CONGENITAL ADRENAL HYPERPLASIA with a deficiency of STEROID 21-HYDROXYLASE.

Molecular Formula

  • C21-H36-O3

Molecular Weight

  • 336.512
 
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Names and Synonyms

Results Name

  • Pregnanetriol

Name of Substance

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

MeSH Heading

  • Pregnanetriol

Synonyms

  • EINECS 214-148-0
  • Pregnanetriol
  • UNII-43822S61TB

Systematic Name

  • 5-beta-Pregnane-3-alpha,17-alpha,20-alpha-triol

Registry Numbers

CAS Registry Number

  • 1098-45-9

FDA UNII

  • 43822S61TB

Other Registry Number

  • 27178-64-9

System Generated Number

  • 0001098459

Structure Descriptors

InChI

1S/C21H36O3/c1-13(22)21(24)11-8-18-16-5-4-14-12-15(23)6-9-19(14,2)17(16)7-10-20(18,21)3/h13-18,22-24H,4-12H2,1-3H3/t13-,14+,15+,16+,17-,18-,19-,20-,21-/m0/s1

InChIKey

SCPADBBISMMJAW-UHHUKTEYSA-N

Smiles

C1[C@]2(C)[C@@](CC[C@H]2[C@@H]2CC[C@H]3[C@@](CC[C@H](C3)O)(C)[C@@H]2C1)([C@@H](O)C)O