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3S-THUNBERGINOL-I-4'-O-GLUCOPYRANOSIDE;3S-(3'-O-METHOXY-4'-O-BETA-D-GLUCOPYRANOSYLPHENYL)-8-HYDROXYDIHYDROISOCOUMARIN
SpectraBase Compound ID LbiUjNpKO1G
InChI InChI=1S/C22H24O10/c1-29-15-7-10(14-8-11-3-2-4-12(24)17(11)21(28)30-14)5-6-13(15)31-22-20(27)19(26)18(25)16(9-23)32-22/h2-7,14,16,18-20,22-27H,8-9H2,1H3/t14-,16-,18-,19+,20-,22-/m0/s1
InChIKey XAKXCHKSCSUXEW-INNMRYKASA-N
Mol Weight 448.42 g/mol
Molecular Formula C22H24O10
Exact Mass 448.136947 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6JbxX4TMbxF
Name 3S-THUNBERGINOL-I-4'-O-GLUCOPYRANOSIDE;3S-(3'-O-METHOXY-4'-O-BETA-D-GLUCOPYRANOSYLPHENYL)-8-HYDROXYDIHYDROISOCOUMARIN
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H24O10
InChI InChI=1S/C22H24O10/c1-29-15-7-10(14-8-11-3-2-4-12(24)17(11)21(28)30-14)5-6-13(15)31-22-20(27)19(26)18(25)16(9-23)32-22/h2-7,14,16,18-20,22-27H,8-9H2,1H3/t14-,16-,18-,19+,20-,22-/m0/s1
InChIKey XAKXCHKSCSUXEW-INNMRYKASA-N
Literature Reference Author M.YOSHIKAWA,T.UEDA,H.SHIMODA,T.MURAKAMI,J.YAMAHARA,H.MATSUDA
Literature Reference Citation CHEM.PHARM.BULL.,47,383(1999)
Literature Reference DOI 10.1248/cpb.47.383
Molecular Weight 448.427 g/mol
Solvent DMSO-D6
Source File Reference UWLU7879