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SCUPONTIN-A;(11S,13S,16S,3'S,3''S)-6-ALPHA-ACETOXY-19-[[3'-[(3''-ACETOXYBUTYRYL)OXY]BUTYRYL]OXY]-4-ALPHA,18;11,16;15,16-TRIEPOXYNEOClEROD-14-EN-2-ALPHA-OL;COMPOU

Compound with spectra: 1 NMR

SCUPONTIN-A;(11S,13S,16S,3'S,3''S)-6-ALPHA-ACETOXY-19-[[3'-[(3''-ACETOXYBUTYRYL)OXY]BUTYRYL]OXY]-4-ALPHA,18;11,16;15,16-TRIEPOXYNEOClEROD-14-EN-2-ALPHA-OL;COMPOU
SpectraBase Compound ID 5ZbsFKyyL7T
InChI InChI=1S/C32H46O12/c1-17-9-26(43-21(5)34)32(16-39-27(36)10-19(3)42-28(37)11-18(2)41-20(4)33)24(13-23(35)14-31(32)15-40-31)30(17,6)25-12-22-7-8-38-29(22)44-25/h7-8,17-19,22-26,29,35H,9-16H2,1-6H3/t17-,18+,19+,22-,23-,24-,25+,26+,29+,30+,31+,32+/m0/s1
InChIKey LMCIEDDINVKNGF-MBKVVHPNSA-N
Mol Weight 622.7 g/mol
Molecular Formula C32H46O12
Exact Mass 622.298927 g/mol
Enantiomer InChIKey LMCIEDDINVKNGF-DYLGRCAJSA-N

View Spectrum of SCUPONTIN-A;(11S,13S,16S,3'S,3''S)-6-ALPHA-ACETOXY-19-[[3'-[(3''-ACETOXYBUTYRYL)OXY]BUTYRYL]OXY]-4-ALPHA,18;11,16;15,16-TRIEPOXYNEOClEROD-14-EN-2-ALPHA-OL;COMPOU

13C NMR Spectrum
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent CDCl3
Title Journal or Book Year
Neoclerodane Diterpenoids from Scutellaria pontica Journal of Natural Products 1997
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