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ANGELOL_C;6_[(1-R,2-S)-1,3-DIHYDROXY-2-METHYLBUTYRYL]-7-METHOXYCOUMARIN;_SEEREMARK__
SpectraBase Compound ID 41ifmK2W9H9
InChI InChI=1S/C20H26O7/c1-6-11(2)19(23)27-18(20(3,4)24)17(22)13-9-12-7-8-16(21)26-14(12)10-15(13)25-5/h7-11,17-18,22,24H,6H2,1-5H3/t11?,17-,18+/m1/s1
InChIKey LEQFGQJFFOQFOZ-CIAGWNDSSA-N
Mol Weight 378.42 g/mol
Molecular Formula C20H26O7
Exact Mass 378.167853 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AE7nzm09K8l
Name ANGELOL_C;6_[(1-R,2-S)-1,3-DIHYDROXY-2-METHYLBUTYRYL]-7-METHOXYCOUMARIN;_SEEREMARK__
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H26O7
InChI InChI=1S/C20H26O7/c1-6-11(2)19(23)27-18(20(3,4)24)17(22)13-9-12-7-8-16(21)26-14(12)10-15(13)25-5/h7-11,17-18,22,24H,6H2,1-5H3/t11?,17-,18+/m1/s1
InChIKey LEQFGQJFFOQFOZ-CIAGWNDSSA-N
Literature Reference Author J.H.LIU,S.X.XU,X.S.YAO,H.KOBAYASHI
Literature Reference Citation PHYTOCHEM.,39,1099(1995)
Literature Reference DOI 10.1016/0031-9422(95)00045-9
Molecular Weight 378.422 g/mol
Solvent CDCl3
Source File Reference UWMZ7649