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2,4-TRANS-FLAVAN-4-OL-6-SULFATE

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2,4-TRANS-FLAVAN-4-OL-6-SULFATE
SpectraBase Compound ID 8AqrSbYVGbD
InChI InChI=1S/C15H14O6S/c16-13-9-15(10-4-2-1-3-5-10)20-14-7-6-11(8-12(13)14)21-22(17,18)19/h1-8,13,15-16H,9H2,(H,17,18,19)/t13-,15+/m1/s1
InChIKey HNRNQJCHXMGQRB-HIFRSBDPSA-N
Mol Weight 322.33 g/mol
Molecular Formula C15H14O6S
Exact Mass 322.051109 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID E2zwpx3opQr
Name 2,4-TRANS-FLAVAN-4-OL-6-SULFATE
Compound Number 12
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C15H14O6S
InChI InChI=1S/C15H14O6S/c16-13-9-15(10-4-2-1-3-5-10)20-14-7-6-11(8-12(13)14)21-22(17,18)19/h1-8,13,15-16H,9H2,(H,17,18,19)/t13-,15+/m1/s1
InChIKey HNRNQJCHXMGQRB-HIFRSBDPSA-N
Literature Reference Author J.R.MIKELL,W.HERATH,I.A.KHAN
Literature Reference Citation CHEM.PHARM.BULL.,63,579(2015)
Literature Reference DOI 10.1248/cpb.c15-00037
Molecular Weight 322.333 g/mol
Solvent DMSO-D6
Source File Reference UWPA10093