Methyl 7alpha-hydroxy-3,3-ethylenedioxy-5beta-cholanoate
Compound with spectra: 1 MS (GC)
| SpectraBase Compound ID | GVGGI6Lf5Pg |
|---|---|
| InChI | InChI=1S/C27H44O5/c1-17(5-8-23(29)30-4)19-6-7-20-24-21(9-10-26(19,20)3)25(2)11-12-27(31-13-14-32-27)16-18(25)15-22(24)28/h17-22,24,28H,5-16H2,1-4H3/t17-,18-,19-,20+,21+,22-,24+,25+,26-/m1/s1 |
| InChIKey | DXMYOONEGIUYNB-NPJWREJRSA-N |
| Mol Weight | 448.6 g/mol |
| Molecular Formula | C27H44O5 |
| Exact Mass | 448.318875 g/mol |
| Enantiomer InChIKey | DXMYOONEGIUYNB-KKOWETEQSA-N |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
|---|---|
| Source of Spectrum | W5-1989-7196-1 |
(5R,7R,8R,9S,10S,13R,14S,17R)-10,13-dimethyl-17-[(1R)-1-methylpropyl]spiro[1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthrene-3,2'-1,3-dioxane]-7-ol
3.beta.,7.beta.-dihydroxy-3.alpha.-methyl-5.beta.-cholanoic acid
N-[3.alpha.,7.beta.-dihydroxy-3.beta.-methyl-24-oxo-5.beta.-cholan-24-yl]-benzylamine
N-[3.beta.,7.beta.-dihydroxy-3.alpha.-methyl-24-oxo-5.beta.-cholan-24-yl]-benzylamine
2-amino-3-[[(6R)-6-[(3S,5R,7R,8R,9S,10S,13R,14S)-3-[3-(4-aminobutylamino)propylamino]-7-hydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]-3-keto-2-methyl-heptyl]thio]propionic acid
(6R)-6-[(3S,5R,7R,8R,9S,10S,13R,14S)-3-[3-(4-aminobutylamino)propylamino]-7-hydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]-2-methylhept-1-en-3-one
[(6R)-6-[(3S,5R,7R,8R,9S,10S,13R,14S)-3-[3-(4-aminobutylamino)propylamino]-7-hydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]-3-keto-2-methyl-heptyl] hydrogen sulfate
DEGRADANT_A
3.beta.-[(t-Butyldimethylsilyl)oxy]-26-(pivaloyloxy)cholest-5.alpha.-an-7-ol
SQUALAMINE
This compound is available in the following databases:
KnowItAll Mass Spectral Library
Author: Wiley
The KnowItAll Mass Spectral Library offers a comprehensive collection of mass spectra, including the renowned Wiley Registry, and access to a wide range of compounds including pure organics, drugs, steroids, additives, geochemicals, petrochemicals, biomarkers, and more. Learn more.
Wiley Registry of Mass Spectral Data 2023
Author: Wiley
The foundation library for any analytical laboratory running mass spectrometry, the Wiley Registry provides the broadest coverage available in any mass spectral library Learn more.