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HEPTYL_PICROPODOPHYLLATE
SpectraBase Compound ID 1H1nzfZ6X3p
InChI InChI=1S/C29H38O9/c1-5-6-7-8-9-10-36-29(32)26-20(15-30)27(31)19-14-22-21(37-16-38-22)13-18(19)25(26)17-11-23(33-2)28(35-4)24(12-17)34-3/h11-14,20,25-27,30-31H,5-10,15-16H2,1-4H3/t20-,25+,26+,27-/m0/s1
InChIKey WIIDQNNUERUNJA-UJODKQELSA-N
Mol Weight 530.6 g/mol
Molecular Formula C29H38O9
Exact Mass 530.251583 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9JOaHwPKm4i
Name HEPTYL_PICROPODOPHYLLATE
Compound Number 5
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C29H38O9
InChI InChI=1S/C29H38O9/c1-5-6-7-8-9-10-36-29(32)26-20(15-30)27(31)19-14-22-21(37-16-38-22)13-18(19)25(26)17-11-23(33-2)28(35-4)24(12-17)34-3/h11-14,20,25-27,30-31H,5-10,15-16H2,1-4H3/t20-,25+,26+,27-/m0/s1
InChIKey WIIDQNNUERUNJA-UJODKQELSA-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 530.615 g/mol
Solvent CDCl3
Source File Reference UWMZ46281