ChemicalBook--->CAS DataBase List--->1098-45-9

1098-45-9

1098-45-9 Structure

1098-45-9 Structure
IdentificationBack Directory
[Name]

5BETA-PREGNANE-3ALPHA,17ALPHA,20ALPHA-TRIOL
[CAS]

1098-45-9
[Synonyms]

NSC 52760
NSC 52760-d4
PREGNANTRIOL
PREGNANETRIOL
Pregnanetriol-d4
5-Pregnan-3a,17a,20-triol-d4
5β-Pregnane-3α,17α,20α-triol
5BETA-PREGNAN-3A,17A,20A-TRIOL
5β-Pregnane-3α,17,20α-triol-d4
5β-Pregnane-3α,17α,20α-triol-d4
(20S)-5β-Pregnane-3α,17,20-triol
(20S)-5β-Pregnane-3α,17α,20-triol
3α,17α,20α-Trihydroxy-5β-pregnane
(3α,5β,20S)-Pregnane-3,17,20-triol
5B-pregnane-3A-17A-20A-triol grade ii
(3α,5β,20S)-Pregnane-3,17,20-triol-d4
5-BETA-PREGNAN-3-ALPHA, 17,20-ALPHA-TRIOL
5BETA-PREGNAN-3ALPHA,17ALPHA,20ALPHA-TRIOL
5BETA-PREGNANE-3ALPHA,17ALPHA,20ALPHA-TRIOL
3ALPHA,17ALPHA,20ALPHA-Trihydroxy-5B-pregnane
Pregnane-3,17,20-triol, (3.alpha.,5.beta.,20S)-
5BETA-PREGNANE-3ALPHA,17ALPHA,20ALPHA-TRIOL 99+%
3ALPHA,17ALPHA,20ALPHA-TRIHYDROXY-5BETA-PREGNANE
3α,17α,20α-Trihydroxy-5β-pregnane, Pregnanetriol
(3R,5R,8R,9S,10S,13S,14S,17R)-17-[(1S)-1-hydroxyethyl]-10,13-dimethyl-1,2,3,4,5,6,7,8,9,11,12,14,15,16-tetradecahydrocyclopenta[a]phenanthrene-3,17-diol
[EINECS(EC#)]

214-148-0
[Molecular Formula]

C21H36O3
[MDL Number]

MFCD00003678
[MOL File]

1098-45-9.mol
[Molecular Weight]

336.51
Chemical PropertiesBack Directory
[Melting point ]

254~255℃
[Boiling point ]

469.9±10.0 °C(Predicted)
[density ]

1.123±0.06 g/cm3(Predicted)
[storage temp. ]

-20°C Freezer, Under inert atmosphere
[solubility ]

chloroform/methanol (9:1): 50 mg/mL, clear, colorless
[form ]

Solid
[pka]

14.80±0.70(Predicted)
[color ]

White to Off-White
[BRN ]

2619975
[CAS DataBase Reference]

1098-45-9
Hazard InformationBack Directory
[Uses]

Labelled Pregnanetriol, a steroid present at elevated levels in the urine of patients with congenital adrenal hyperplasma. During treatment with cortisol replacement, elevated urine Pregnanetriol leve ls indicate insufficient dosage of cortisol. Pregnanetriol is also one of the urinary marker for adrenal incidentaloma. Pregnanetriol is a metabolite of Androstenedione (A637550).
[Uses]

Pregnanetriol is a steroid present at elevated levels in the urine of patients with congenital adrenal hyperplasma. During treatment with cortisol replacement, elevated urine Pregnanetriol levels indi cate insufficient dosage of cortisol. Pregnanetriol is also one of the urinary marker for adrenal incidentaloma. Pregnanetriol is a metabolite of Androstenedione (A637550).
[Definition]

ChEBI: 5beta-Pregnane-3alpha,17alpha,20alpha-triol is a corticosteroid hormone.
[storage]

-20°C
Safety DataBack Directory
[Safety Statements ]

22-24/25
[WGK Germany ]

3
Spectrum DetailBack Directory
[Spectrum Detail]

5BETA-PREGNANE-3ALPHA,17ALPHA,20ALPHA-TRIOL(1098-45-9)1HNMR
5BETA-PREGNANE-3ALPHA,17ALPHA,20ALPHA-TRIOL(1098-45-9)Raman
5BETA-PREGNANE-3ALPHA,17ALPHA,20ALPHA-TRIOL(1098-45-9)IR
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