For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
Pregnane-3,20-diol, diformate, (3.alpha.,5.beta.,20S)-
SpectraBase Compound ID 9BXJWrcMiLg
InChI InChI=1S/C23H36O4/c1-15(26-13-24)19-6-7-20-18-5-4-16-12-17(27-14-25)8-10-22(16,2)21(18)9-11-23(19,20)3/h13-21H,4-12H2,1-3H3
InChIKey BLLDJXKMYCTWAL-UHFFFAOYSA-N
Mol Weight 376.5 g/mol
Molecular Formula C23H36O4
Exact Mass 376.26136 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID ELz2dp6B9nM
Name Pregnane-3,20-diol, diformate, (3.alpha.,5.beta.,20S)-
CAS Registry Number 67708-37-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H36O4
InChI InChI=1S/C23H36O4/c1-15(26-13-24)19-6-7-20-18-5-4-16-12-17(27-14-25)8-10-22(16,2)21(18)9-11-23(19,20)3/h13-21H,4-12H2,1-3H3
InChIKey BLLDJXKMYCTWAL-UHFFFAOYSA-N
Molecular Weight 376.537 g/mol
SMILES C(=O)OC1CCC2(C(CCC3C4C(CCC23)(C(CC4)C(C)OC=O)C)C1)C
SPLASH splash10-0159-0193000000-eead06c341ec51c0a81a
Source of Spectrum KO-6-163-1
Synonyms 20-(Formyloxy)pregnan-3-yl formate 5.beta.-Pregnane-3.alpha.,20.alpha.-diol, diformate Pregnane-3,20-diol, diformate, (3.alpha.,5.beta.,2OS)- [17-(1-formyloxyethyl)-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-yl] formate [17-(1-methanoyloxyethyl)-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-yl] methanoate
Wiley ID 1357956