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

*Links on SpectraBase are not permalinks.

CAESALPIN_A;1-ALPHA,6-ALPHA-DIACETOXY-5-ALPHA-HYDROXY-15-CARBOXYMETHYL-12-OXOCASSA-7-(8),13-(14)-DIENE

Compound with spectra: 1 NMR

CAESALPIN_A;1-ALPHA,6-ALPHA-DIACETOXY-5-ALPHA-HYDROXY-15-CARBOXYMETHYL-12-OXOCASSA-7-(8),13-(14)-DIENE
SpectraBase Compound ID LGDS2hcpyaB
InChI InChI=1S/C25H34O8/c1-13-16-10-21(33-15(3)27)25(30)23(4,5)9-8-20(32-14(2)26)24(25,6)18(16)12-19(28)17(13)11-22(29)31-7/h10,18,20-21,30H,8-9,11-12H2,1-7H3/t18-,20-,21-,24-,25+/m0/s1
InChIKey YTZARYJQPZLCDE-LZDJTLFVSA-N
Mol Weight 462.5 g/mol
Molecular Formula C25H34O8
Exact Mass 462.225368 g/mol
Enantiomer InChIKey YTZARYJQPZLCDE-LQABMAAXSA-N

View Spectrum of CAESALPIN_A;1-ALPHA,6-ALPHA-DIACETOXY-5-ALPHA-HYDROXY-15-CARBOXYMETHYL-12-OXOCASSA-7-(8),13-(14)-DIENE

13C NMR Spectrum
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent CDCl3
Title Journal or Book Year
Caesalpins A–H, Bioactive Cassane-Type Diterpenes from the Seeds of Caesalpinia minax Journal of Natural Products 2013

KnowItAll NMR Spectral Library
Author: Wiley

The KnowItAll NMR Spectral Library offers a comprehensive collection of NMR reference spectra, including NMR, CNMR, and XNMR, and covers a wide range of compounds including organics, polymers, monomers, metabolites, and more. Learn more.

Other Resources
Unknown Identification

Search your unknown spectrum against the world's largest collection of reference spectra

KnowItAll Campus Solutions

KnowItAll offers faculty and students at your school access to all the tools you need for spectral analysis and structure drawing & publishing! Plus, access the world's largest spectral library.