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(25R)-Nuatigenin diacetate

View entire compound with spectra: 8 NMR, and 2 MS (GC)

(25R)-Nuatigenin diacetate
SpectraBase Compound ID 77YZZv6a9Uy
InChI InChI=1S/C31H46O6/c1-18-27-26(36-31(18)14-13-28(4,37-31)17-34-19(2)32)16-25-23-8-7-21-15-22(35-20(3)33)9-11-29(21,5)24(23)10-12-30(25,27)6/h7,18,22-27H,8-17H2,1-6H3
InChIKey KKBVNPPUTWMILP-UHFFFAOYSA-N
Mol Weight 514.7 g/mol
Molecular Formula C31H46O6
Exact Mass 514.329439 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2QC1XmUMR89
Name (25S)-Nuatigenin diacetate
CAS Registry Number 56196-24-8
Comments *25S
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C31H46O6
InChI InChI=1S/C31H46O6/c1-18-27-26(36-31(18)14-13-28(4,37-31)17-34-19(2)32)16-25-23-8-7-21-15-22(35-20(3)33)9-11-29(21,5)24(23)10-12-30(25,27)6/h7,18,22-27H,8-17H2,1-6H3
InChIKey KKBVNPPUTWMILP-UHFFFAOYSA-N
Literature Reference R. Tschesche, W. Fuehrer, Chem. Ber. 111, 3300 (1978).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3