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PODECDYSONE_B_20,22-ACETONIDE;(20-R,22-R)-20,22-O-ISOPROPYLIDENE-2-BETA,3-BETA,25-TRIHYDROXY-5-BETA-CHOLESTA-8,14-DIEN-6-ONE

View entire compound with spectra: 1 NMR

PODECDYSONE_B_20,22-ACETONIDE;(20-R,22-R)-20,22-O-ISOPROPYLIDENE-2-BETA,3-BETA,25-TRIHYDROXY-5-BETA-CHOLESTA-8,14-DIEN-6-ONE
SpectraBase Compound ID 5WEuYpwDH0n
InChI InChI=1S/C30H46O6/c1-26(2,34)12-11-25-30(7,36-27(3,4)35-25)24-9-8-18-17-14-21(31)20-15-22(32)23(33)16-29(20,6)19(17)10-13-28(18,24)5/h8,20,22-25,32-34H,9-16H2,1-7H3/t20-,22+,23-,24-,25+,28-,29+,30-/m0/s1
InChIKey POKOTBWDXKLEPJ-AADKUTKGSA-N
Mol Weight 502.7 g/mol
Molecular Formula C30H46O6
Exact Mass 502.329439 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DswIFAE4OV9
Name PODECDYSONE_B_20,22-ACETONIDE;(20-R,22-R)-20,22-O-ISOPROPYLIDENE-2-BETA,3-BETA,25-TRIHYDROXY-5-BETA-CHOLESTA-8,14-DIEN-6-ONE
Compound Number III
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C30H46O6
InChI InChI=1S/C30H46O6/c1-26(2,34)12-11-25-30(7,36-27(3,4)35-25)24-9-8-18-17-14-21(31)20-15-22(32)23(33)16-29(20,6)19(17)10-13-28(18,24)5/h8,20,22-25,32-34H,9-16H2,1-7H3/t20-,22+,23-,24-,25+,28-,29+,30-/m0/s1
InChIKey POKOTBWDXKLEPJ-AADKUTKGSA-N
Literature Reference Author V.N.ODINOKOV,I.V.GALYAUTDINOV,D.V.NEDOPEKIN,N.A.VESKINA,L.M. KHALILOV
Literature Reference Citation RUSS.J.ORG.CHEM.,39,952(2003)
Literature Reference DOI 10.1023/B:RUJO.0000003183.84168.79
Molecular Weight 502.692 g/mol
Solvent CDCl3
Source File Reference UWMZ21587