SpectraBase Compound ID | HEn9F9Qtlcb |
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InChI | InChI=1S/C21H34O4/c1-20-8-7-13(23)9-12(20)3-4-14-15-5-6-16(18(25)11-22)21(15,2)10-17(24)19(14)20/h12-16,18-19,22-23,25H,3-11H2,1-2H3/t12-,13-,14+,15+,16-,18-,19-,20+,21+/m1/s1 |
InChIKey | NGYONPIMXAHRCT-JACSKPEYSA-N |
Mol Weight | 350.5 g/mol |
Molecular Formula | C21H34O4 |
Exact Mass | 350.24571 g/mol |
SpectraBase Spectrum ID | AJqFKq4a7Vm |
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Name | 3α,20β,21-trihydroxypregnan-11-one |
Source of Sample | M. L. LEWBART, CROZER-CHESTER MEDICAL CENTER, CHESTER, PENNSYLVANIA |
Copyright | Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C21H34O4 |
InChI | InChI=1S/C21H34O4/c1-20-8-7-13(23)9-12(20)3-4-14-15-5-6-16(18(25)11-22)21(15,2)10-17(24)19(14)20/h12-16,18-19,22-23,25H,3-11H2,1-2H3/t12-,13-,14+,15+,16-,18-,19-,20+,21+/m1/s1 |
InChIKey | NGYONPIMXAHRCT-JACSKPEYSA-N |
Melting Point | 233-234.5C |
Molecular Weight | 350.50 |
Technique | KBr WAFER |