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

*Links on SpectraBase are not permalinks.
COBrYNIC-ACID-HEPTAMETHYLESTER
SpectraBase Compound ID KLpZW5V3OCY
InChI InChI=1S/C52H73N4O14.2ClH.Co/c1-28-43-31(17-20-37(58)65-10)48(3,4)35(54-43)25-34-30(16-19-36(57)64-9)50(6,26-41(62)69-14)46(53-34)29(2)44-32(18-21-38(59)66-11)51(7,27-42(63)70-15)52(8,56-44)47-33(24-40(61)68-13)49(5,45(28)55-47)23-22-39(60)67-12;;;/h25,30-33,47H,16-24,26-27H2,1-15H3;2*1H;/q-1;;;+3/p-2/t30-,31-,32-,33+,47-,49-,50+,51+,52+;;;/m1.../s1/i36+1,37+1,38+1,39+1,41+1,42+1,57+2,58+2,59+2,62+2,63+2,64+2,65+2,66+2,69+2,70+2;;;
InChIKey LATLJFSRHWLHDK-WSGYXXCYSA-L
Mol Weight 1134.0 g/mol
Molecular Formula C4613C6H73Cl2CoN4O418O10
Exact Mass 1132.445806 g/mol
Parent InChIKey CZEGMGAIEDPCHL-GSECKKMTSA-L
Enantiomer InChIKey LATLJFSRHWLHDK-SQTYBERLSA-L
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent C6D6;KCN-SATURATED
Title Journal or Book Year
Biosynthesis of porphyrins and related macrocycles. Part 41. Fate of oxygen atoms as precorrin-2 carrying eight labelled carboxyl groups (13C18O2H) is enzymatically converted into cobyrinic acid Journal of the Chemical Society, Perkin Transactions 1 1993

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.