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

*Links on SpectraBase are not permalinks.
CRYPTOPORIC-ACID-G-TRI-PARA-BROMOPHENACYLESTER;CA-F-TRI-PARA-BROMOPHENACYLESTER
SpectraBase Compound ID 97n136YK5GA
InChI InChI=1S/C68H81Br3O18/c1-40-11-25-55-65(3,38-72)27-9-29-67(55,5)50(40)33-87-60(64(81)83-8)49(32-58(77)85-36-53(74)43-15-21-46(70)22-16-43)62(79)89-39-66(4)28-10-30-68(6)51(41(2)12-26-56(66)68)34-86-59(63(80)82-7)48(61(78)88-37-54(75)44-17-23-47(71)24-18-44)31-57(76)84-35-52(73)42-13-19-45(69)20-14-42/h13-24,48-51,55-56,59-60,72H,1-2,9-12,25-39H2,3-8H3/t48-,49+,50-,51+,55?,56?,59+,60-,65-,66+,67+,68-/m0/s1
InChIKey IKTVPVWLXIBCSF-OMHPJNDCSA-N
Mol Weight 1426.1 g/mol
Molecular Formula C68H81Br3O18
Exact Mass 1422.297305 g/mol
Enantiomer InChIKey IKTVPVWLXIBCSF-IFQYSZHFSA-N
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent CDCl3
Title Journal or Book Year
Cryptoporic acids A-G, drimane-type sesquiterpenoid ethers of isocitric acid from the fungus Cryptoporus volvatus Phytochemistry 1992

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.