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HEPTYL_9-DEOXY-9-OXO-ALPHA-APOPICROPODOPHYLLATE
SpectraBase Compound ID Cn5QLLi0mZo
InChI InChI=1S/C29H34O8/c1-5-6-7-8-9-10-35-29(31)27-20(16-30)11-18-12-22-23(37-17-36-22)15-21(18)26(27)19-13-24(32-2)28(34-4)25(14-19)33-3/h11-16,26-27H,5-10,17H2,1-4H3/t26-,27-/m1/s1
InChIKey ZNGGPTCPVTVPND-KAYWLYCHSA-N
Mol Weight 510.6 g/mol
Molecular Formula C29H34O8
Exact Mass 510.225368 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9xeOXyWrEEW
Name HEPTYL_9-DEOXY-9-OXO-ALPHA-APOPICROPODOPHYLLATE
Compound Number 12
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C29H34O8
InChI InChI=1S/C29H34O8/c1-5-6-7-8-9-10-35-29(31)27-20(16-30)11-18-12-22-23(37-17-36-22)15-21(18)26(27)19-13-24(32-2)28(34-4)25(14-19)33-3/h11-16,26-27H,5-10,17H2,1-4H3/t26-,27-/m1/s1
InChIKey ZNGGPTCPVTVPND-KAYWLYCHSA-N
Literature Reference Author M.A.CASTRO,J.M.M.DELCORRAL,P.A.GARCIA,M.V.ROJO,J.DELAIGLESIA S-VICENTE,F.MOLLINED
Literature Reference Citation J.MED.CHEM.,53,983(2010)
Literature Reference DOI 10.1021/jm901373w
Molecular Weight 510.584 g/mol
Solvent CDCl3
Source File Reference UWMZ46289