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CORIAHEPTOCIN-A-14,16,19,20-DIACETONIDE
SpectraBase Compound ID HUvTGpXdTEl
InChI InChI=1S/C41H72O10/c1-7-8-9-10-11-12-13-14-15-16-17-37-38(51-41(5,6)50-37)21-19-31-26-32(49-40(3,4)48-31)27-34(44)36-23-22-35(47-36)33(43)20-18-30(42)25-29-24-28(2)46-39(29)45/h24,28,30-38,42-44H,7-23,25-27H2,1-6H3/t28?,30?,31-,32+,33-,34+,35+,36+,37+,38+/m0/s1
InChIKey YPDQWYRKCLVYAJ-QGVJJIDKSA-N
Mol Weight 725.0 g/mol
Molecular Formula C41H72O10
Exact Mass 724.512549 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID G7BOQ4A6g0J
Name CORIAHEPTOCIN-A-14,16,19,20-DIACETONIDE
Compound Number 1A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C41H72O10
InChI InChI=1S/C41H72O10/c1-7-8-9-10-11-12-13-14-15-16-17-37-38(51-41(5,6)50-37)21-19-31-26-32(49-40(3,4)48-31)27-34(44)36-23-22-35(47-36)33(43)20-18-30(42)25-29-24-28(2)46-39(29)45/h24,28,30-38,42-44H,7-23,25-27H2,1-6H3/t28?,30?,31-,32+,33-,34+,35+,36+,37+,38+/m0/s1
InChIKey YPDQWYRKCLVYAJ-QGVJJIDKSA-N
Literature Reference Author E.L.M.DASILVA,F.ROBLOT,O.LAPREVOTE,L.SERANI,A.CAVE
Literature Reference Citation J.NAT.PROD.,60,162(1997)
Literature Reference DOI 10.1021/np9606660
Molecular Weight 725.017 g/mol
Solvent CDCl3:CD3OD=95:5
Source File Reference UWGS95