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5β-pregn-16-ene-3α,20α,21-triol, 3-acetate, cyclic 20,21-carbonate

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5β-pregn-16-ene-3α,20α,21-triol, 3-acetate, cyclic 20,21-carbonate
SpectraBase Compound ID 7WQZ1CbhGag
InChI InChI=1S/C24H34O5/c1-14(25)28-16-8-10-23(2)15(12-16)4-5-17-18-6-7-20(21-13-27-22(26)29-21)24(18,3)11-9-19(17)23/h7,15-19,21H,4-6,8-13H2,1-3H3/t15-,16-,17+,18+,19+,21+,23+,24+/m1/s1
InChIKey DHESAXJJOFZGGH-RIEFNCJYSA-N
Mol Weight 402.5 g/mol
Molecular Formula C24H34O5
Exact Mass 402.240624 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID EDdlTNRorfr
Name 5β-pregn-16-ene-3α,20α,21-triol, 3-acetate, cyclic 20,21-carbonate
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 C24H34O5
InChI InChI=1S/C24H34O5/c1-14(25)28-16-8-10-23(2)15(12-16)4-5-17-18-6-7-20(21-13-27-22(26)29-21)24(18,3)11-9-19(17)23/h7,15-19,21H,4-6,8-13H2,1-3H3/t15-,16-,17+,18+,19+,21+,23+,24+/m1/s1
InChIKey DHESAXJJOFZGGH-RIEFNCJYSA-N
Melting Point 110-115C
Molecular Weight 402.531006
Synonyms 5B-PREGN-16-ENE-3A,20A,21-TRIOL, 3-ACETATE, CYCLIC 20,21-CARBONATE
Technique KBr WAFER