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3-BETA-ACETOXY-5-ALPHA,6-ALPHA-EPOXY-BETA-IONONE-2-ALPHA-O-(2,3,4,6-TETRAACETOXY-BETA-D-GLUCOPYRANOSIDE)
SpectraBase Compound ID 9dUnvoUeAgL
InChI InChI=1S/C29H40O14/c1-14(30)10-11-29-27(7,8)25(20(37-16(3)32)12-28(29,9)43-29)42-26-24(40-19(6)35)23(39-18(5)34)22(38-17(4)33)21(41-26)13-36-15(2)31/h10-11,20-26H,12-13H2,1-9H3/b11-10+/t20-,21+,22+,23-,24+,25-,26-,28-,29+/m1/s1
InChIKey UPJAKQJQIFEWCQ-LBNCTFJJSA-N
Mol Weight 612.6 g/mol
Molecular Formula C29H40O14
Exact Mass 612.241806 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EqoPPizK8H4
Name 3-BETA-ACETOXY-5-ALPHA,6-ALPHA-EPOXY-BETA-IONONE-2-ALPHA-O-(2,3,4,6-TETRAACETOXY-BETA-D-GLUCOPYRANOSIDE)
Compound Number 1A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C29H40O14
InChI InChI=1S/C29H40O14/c1-14(30)10-11-29-27(7,8)25(20(37-16(3)32)12-28(29,9)43-29)42-26-24(40-19(6)35)23(39-18(5)34)22(38-17(4)33)21(41-26)13-36-15(2)31/h10-11,20-26H,12-13H2,1-9H3/b11-10+/t20-,21+,22+,23-,24+,25-,26-,28-,29+/m1/s1
InChIKey UPJAKQJQIFEWCQ-LBNCTFJJSA-N
Literature Reference Author M.H.OUESLATI,H.B.JANNET,Z.MIGHRI,J.CHRIAA,P.M.ABREU
Literature Reference Citation J.NAT.PROD.,69,1366(2006)
Literature Reference DOI 10.1021/np060222w
Molecular Weight 612.628 g/mol
Solvent CDCl3
Source File Reference UWMZ15716