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Epothilone c-1

Compound with spectra: 2 NMR, and 2 MS (GC)

Epothilone c-1
SpectraBase Compound ID H0WjbOEjiJv
InChI InChI=1S/C25H37NO5S/c1-15-10-8-6-7-9-11-22(16(2)12-20-14-32-19(5)26-20)31-23(28)13-21(27)17(3)25(30)18(4)24(15)29/h7,9,12,14-15,17-18,21-22,24,27,29H,6,8,10-11,13H2,1-5H3/b9-7-,16-12+/t15-,17?,18+,21-,22-,24-/m0/s1
InChIKey GGEZPMGQYPDHAV-BFDQYSKISA-N
Mol Weight 463.6 g/mol
Molecular Formula C25H37NO5S
Exact Mass 463.239244 g/mol
Enantiomer InChIKey GGEZPMGQYPDHAV-ZYSRMAAKSA-N

View Spectrum of Epothilone c-1

MS (GC) Spectrum
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Source of Spectrum G4-64-854-18

View Spectrum of Epothilone c-1

MS (GC) Spectrum
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Source of Spectrum G4-64-853-16

View Spectrum of Epothilone c-1

13C NMR Spectrum
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent CDCl3

View Spectrum of Epothilone c-1

13C NMR Spectrum
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent CDCl3
  • EPOTHILONE-C2
(trans)-epothilone c-1
(trans)-epothilone c-1
(trans)-epothilone c-2
Epothilone c-3
6-DEOXYERYTHRONOLIDE
6-Deoxy-erythronolide B
1.beta.,2.beta.,3.beta.,9.beta.-Tetrahydro-1.alpha.-hydroxy-oxobicyclo[6.3.0]undecane-3.alpha.-carboxylic acid .gamma.-lactone
(1R*,2R*,3S*,9R*)-8-Oxobicyclo[6.3.0]undecane-1,3-carbolactone
7-DEOXY-8,21,23-HEXAHYDRODISCODERMOLIDE
PLAKORTONE_M
2-Pentenoic acid, 5-(8-iodo-7-oxo-6-oxabicyclo[3.2.1]oct-2-en-1-yl)-, 1,1-dimethylethyl ester, [1.alpha.,1(E),5.alpha.,8R*]-(.+-.)-
8,13,21,23-OCTAHYDRODISCODERMOLIDE
MIGRASTATIN
Title Journal or Book Year
New Natural Epothilones from Sorangium cellulosum, Strains So ce90/B2 and So ce90/D13:  Isolation, Structure Elucidation, and SAR Studies Journal of Natural Products 2001

This compound is available in the following databases:

Wiley Registry of Mass Spectral Data 2023
Author: Wiley

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