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

*Links on SpectraBase are not permalinks.
[METHYL-3-CHLORO-5-O-(3-CHLOROBENZOYL)-2,3-DIDEOXY-N-((1'S)-1'-[(3''S)-3'',4''-DIHYDRO-8''-HYDROXY-1''-OXO-1''H-2''-BENZOPYRAN-3''-YL]-3'-METHYLBUTYL)-ALPHA-D-ARABINO-
SpectraBase Compound ID LLdlse5CI9R
InChI InChI=1S/C28H31Cl2NO8/c1-14(2)10-19(21-12-15-6-5-9-20(32)23(15)28(35)37-21)31-26(33)25(24-18(30)13-22(36-3)38-24)39-27(34)16-7-4-8-17(29)11-16/h4-9,11,14,18-19,21-22,24-25,32H,10,12-13H2,1-3H3,(H,31,33)/t18-,19-,21-,22+,24+,25-/m0/s1
InChIKey MMMFLXABIAPIHR-KDIXXLTNSA-N
Mol Weight 580.46 g/mol
Molecular Formula C28H31Cl2NO8
Exact Mass 579.142672 g/mol
Enantiomer InChIKey MMMFLXABIAPIHR-LJVLCQFTSA-N
  • [METHYL-3-CHLORO-5-O-(3-CHLOROBENZOYL)-2,3-DIDEOXY-N-((1'S)-1'-[(3''S)-3'',4''-DIHYDRO-8''-HYDROXY-1''-OXO-1''H-2''-BENZOPYRAN-3''-YL]-3'-METHYLBUTYL)-ALPHA-L-ARABINO-
Title Journal or Book Year
Total Synthesis of the Gastroprotective Substance AI-77-B and of Analogues Helvetica Chimica Acta 1993

This compound is available in the following databases:

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.

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.