John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=CXx93Cf6zIH SpectraBase Spectrum ID=8k4PQgIOywF

(accessed ).
ANHYDROAFROGENIN-2-ALPHA,3-BETA-DIACETAT,(5-ALPHA,14-ALPHA-H)
SpectraBase Compound ID CXx93Cf6zIH
InChI InChI=1S/C27H36O7/c1-14(28)33-22-10-17-5-6-18-19(27(17,4)12-23(22)34-15(2)29)7-8-26(3)20(11-21(30)25(18)26)16-9-24(31)32-13-16/h9,17-20,22-23,25H,5-8,10-13H2,1-4H3/t17-,18+,19-,20+,22+,23+,25+,26+,27-/m0/s1
InChIKey GSWJWINTISGHFW-SVTHYSKTSA-N
Mol Weight 472.6 g/mol
Molecular Formula C27H36O7
Exact Mass 472.246104 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8k4PQgIOywF
Name ANHYDROAFROGENIN-2-ALPHA,3-BETA-DIACETAT,(5-ALPHA,14-ALPHA-H)
Copyright Copyright © 2016-2021 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C27H36O7
InChI InChI=1S/C27H36O7/c1-14(28)33-22-10-17-5-6-18-19(27(17,4)12-23(22)34-15(2)29)7-8-26(3)20(11-21(30)25(18)26)16-9-24(31)32-13-16/h9,17-20,22-23,25H,5-8,10-13H2,1-4H3/t17-,18+,19-,20+,22+,23+,25+,26+,27-/m0/s1
InChIKey GSWJWINTISGHFW-SVTHYSKTSA-N
Literature Reference Author H.T.A.CHEUNG,R.G.COOMBE,W.T.L.SIDWELL,T.R.WATSON
Literature Reference Citation J.CHEM.SOC.PERKIN-1,64(1981)
Literature Reference DOI 10.1039/p19810000064
Molecular Weight 472.579 g/mol
Solvent CDCl3
Source File Reference UNIW8505
SpectraBase Batch ID 8nEfnvT0d22