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IRISTECTORENE-C
SpectraBase Compound ID 15ymONRhUPO
InChI InChI=1S/C46H78O5/c1-9-10-11-12-13-14-15-16-17-18-19-20-21-29-44(49)51-35-24-28-42-41(40(6)36-47)32-34-46(8,50)45(42,7)33-23-27-39(5)43(48)31-30-38(4)26-22-25-37(2)3/h12-13,25,27,30,36,42-43,48,50H,9-11,14-24,26,28-29,31-35H2,1-8H3/b13-12+,38-30+,39-27+,41-40-/t42-,43?,45+,46+/m1/s1
InChIKey RHGTXJLTQOSXCQ-GFXGRPGCSA-N
Mol Weight 711.1 g/mol
Molecular Formula C46H78O5
Exact Mass 710.584926 g/mol
Enantiomer InChIKey RHGTXJLTQOSXCQ-OYQFZDQRSA-N
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent CDCl3
Title Journal or Book Year
Iristectorenes A and C-G, monocyclic triterpene esters from Iris tectorum Phytochemistry 1994

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