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1,3,5,11-ALPHA,14,19-HEXAHYDROXY-CARD-20(22)-ENOLIDE,OUABAGENIN

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1,3,5,11-ALPHA,14,19-HEXAHYDROXY-CARD-20(22)-ENOLIDE,OUABAGENIN
SpectraBase Compound ID HbJnmSNxQXT
InChI InChI=1S/C23H34O8/c1-20-9-16(26)19-15(23(20,30)5-3-14(20)12-6-18(28)31-10-12)2-4-21(29)8-13(25)7-17(27)22(19,21)11-24/h6,13-17,19,24-27,29-30H,2-5,7-11H2,1H3/t13-,14+,15+,16+,17+,19+,20+,21-,22+,23-/m0/s1
InChIKey BXSABLKMKAINIU-QOHCMMFCSA-N
Mol Weight 438.5 g/mol
Molecular Formula C23H34O8
Exact Mass 438.225368 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BAIbAqwLx8B
Name 1,3,5,11-ALPHA,14,19-HEXAHYDROXY-CARD-20(22)-ENOLIDE,OUABAGENIN
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C23H34O8
InChI InChI=1S/C23H34O8/c1-20-9-16(26)19-15(23(20,30)5-3-14(20)12-6-18(28)31-10-12)2-4-21(29)8-13(25)7-17(27)22(19,21)11-24/h6,13-17,19,24-27,29-30H,2-5,7-11H2,1H3/t13-,14+,15+,16+,17+,19+,20+,21-,22+,23-/m0/s1
InChIKey BXSABLKMKAINIU-QOHCMMFCSA-N
Literature Reference Author D.D.MCINTYRE,M.W.GERMANN,H.J.VOGEL
Literature Reference Citation CAN.J.CHEM.,68,1263(1990)
Literature Reference DOI 10.1139/v90-195
Molecular Weight 438.518 g/mol
Solvent CDCl3:DMSO=1:2
Source File Reference UWED11147