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ASTRINGIN

View entire compound with spectra: 2 NMR

ASTRINGIN
SpectraBase Compound ID H51lZLKAMTh
InChI InChI=1S/C20H22O9/c21-9-16-17(25)18(26)19(27)20(29-16)28-13-6-11(5-12(22)8-13)2-1-10-3-4-14(23)15(24)7-10/h1-8,16-27H,9H2/b2-1+/t16-,17-,18+,19-,20-/m0/s1
InChIKey PERPNFLGJXUDDW-FSONJKCJSA-N
Mol Weight 406.39 g/mol
Molecular Formula C20H22O9
Exact Mass 406.126382 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KzorWMHlaGC
Name ASTRINGIN
Compound Number 12
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H22O9
InChI InChI=1S/C20H22O9/c21-9-16-17(25)18(26)19(27)20(29-16)28-13-6-11(5-12(22)8-13)2-1-10-3-4-14(23)15(24)7-10/h1-8,16-27H,9H2/b2-1+/t16-,17-,18+,19-,20-/m0/s1
InChIKey PERPNFLGJXUDDW-FSONJKCJSA-N
Literature Reference Author Y.MIYAICHI,N.NUNOMURA,Y.KAWATA,H.KIZU,T.TOMIMORI,T.WATANABE, A.TAKANO,K.Y.MALLA
Literature Reference Citation CHEM.PHARM.BULL.,54,136(2006)
Literature Reference DOI 10.1248/cpb.54.136
Molecular Weight 406.389 g/mol
Sample ID 54831
Solvent DMSO-D6