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5β-pregnane-3α,20α,21-triol, 3,21-diacetate

View entire compound with spectra: 1 FTIR

5β-pregnane-3α,20α,21-triol, 3,21-diacetate
SpectraBase Compound ID 7g0bI7E2ntv
InChI InChI=1S/C25H40O5/c1-15(26)29-14-23(28)22-8-7-20-19-6-5-17-13-18(30-16(2)27)9-11-24(17,3)21(19)10-12-25(20,22)4/h17-23,28H,5-14H2,1-4H3/t17-,18-,19+,20+,21+,22-,23+,24+,25+/m1/s1
InChIKey OZASIKCBDLCYIK-XFIVGHOZSA-N
Mol Weight 420.6 g/mol
Molecular Formula C25H40O5
Exact Mass 420.287574 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID 54CpnscCe0R
Name 5β-pregnane-3α,20α,21-triol, 3,21-diacetate
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 C25H40O5
InChI InChI=1S/C25H40O5/c1-15(26)29-14-23(28)22-8-7-20-19-6-5-17-13-18(30-16(2)27)9-11-24(17,3)21(19)10-12-25(20,22)4/h17-23,28H,5-14H2,1-4H3/t17-,18-,19+,20+,21+,22-,23+,24+,25+/m1/s1
InChIKey OZASIKCBDLCYIK-XFIVGHOZSA-N
Melting Point 135-137C
Molecular Weight 420.589996
Synonyms 5B-PREGNANE-3A,20A,21-TRIOL, 3,21-DI- ACETATE
Technique KBr WAFER