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11α,20β,21-trihydroxypregn-4-en-3-one, 20-acetate

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11α,20β,21-trihydroxypregn-4-en-3-one, 20-acetate
SpectraBase Compound ID Cfl3mvPjbpm
InChI InChI=1S/C23H34O5/c1-13(25)28-20(12-24)18-7-6-17-16-5-4-14-10-15(26)8-9-22(14,2)21(16)19(27)11-23(17,18)3/h10,16-21,24,27H,4-9,11-12H2,1-3H3/t16-,17-,18+,19+,20+,21+,22-,23-/m0/s1
InChIKey JPBGWEMFLWGZNK-DNNYETPZSA-N
Mol Weight 390.5 g/mol
Molecular Formula C23H34O5
Exact Mass 390.240624 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID Vqp5zJnC6t
Name 11α,20β,21-trihydroxypregn-4-en-3-one, 20-acetate
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 C23H34O5
InChI InChI=1S/C23H34O5/c1-13(25)28-20(12-24)18-7-6-17-16-5-4-14-10-15(26)8-9-22(14,2)21(16)19(27)11-23(17,18)3/h10,16-21,24,27H,4-9,11-12H2,1-3H3/t16-,17-,18+,19+,20+,21+,22-,23-/m0/s1
InChIKey JPBGWEMFLWGZNK-DNNYETPZSA-N
Literature Reference J. ORG. CHEM. 29, 2559(1964) Abstract-Chemical Abstracts= 61, 10739(1964)
Melting Point 185-187.5C
Molecular Weight 390.519989
Synonyms PREGN-4-EN-3-ONE, 11A,20B,21-TRI- HYDROXY-, 20-ACETATE
Technique KBr WAFER