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1beta-HYDROXYBACCATIN-I
SpectraBase Compound ID BHYs8o2onLa
InChI InChI=1S/C32H44O14/c1-14-21(41-15(2)33)12-32(39)28(46-20(7)38)26-30(10,22(42-16(3)34)11-23(43-17(4)35)31(26)13-40-31)27(45-19(6)37)25(44-18(5)36)24(14)29(32,8)9/h21-23,25-28,39H,11-13H2,1-10H3/t21-,22-,23-,25+,26-,27-,28-,30+,31+,32+/m0/s1
InChIKey LUTPIRPNUNHFEV-MBMCFSISSA-N
Mol Weight 652.7 g/mol
Molecular Formula C32H44O14
Exact Mass 652.273106 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KgJLk4LGT4h
Name 1-BETA-HYDROXYBACCATIN-I
Compound Number 6
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C32H44O14
InChI InChI=1S/C32H44O14/c1-14-21(41-15(2)33)12-32(39)28(46-20(7)38)26-30(10,22(42-16(3)34)11-23(43-17(4)35)31(26)13-40-31)27(45-19(6)37)25(44-18(5)36)24(14)29(32,8)9/h21-23,25-28,39H,11-13H2,1-10H3/t21-,22-,23-,25+,26-,27-,28-,30+,31+,32+/m0/s1
InChIKey LUTPIRPNUNHFEV-MBMCFSISSA-N
Literature Reference Author Z.HONGJIE,M.QING,X.WEI,Y.PING,S.HANDONG,Y.TAKEDA
Literature Reference Citation PHYTOCHEM.,44,911(1997)
Literature Reference DOI 10.1016/S0031-9422(96)00658-9
Molecular Weight 652.693 g/mol
Solvent CDCl3
Source File Reference UWPA326