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PHYLLODULCIN-3'-O-BETA-GLUCURONIDE

View entire compound with spectra: 1 NMR

PHYLLODULCIN-3'-O-BETA-GLUCURONIDE
SpectraBase Compound ID ISoT9gdofDS
InChI InChI=1S/C22H22O11/c1-30-12-6-5-9(13-8-10-3-2-4-11(23)15(10)21(29)31-13)7-14(12)32-22-18(26)16(24)17(25)19(33-22)20(27)28/h2-7,13,16-19,22-26H,8H2,1H3,(H,27,28)/t13?,16-,17-,18+,19-,22+/m1/s1
InChIKey GZIKQVZOPMIRMI-CBYJIQGBSA-N
Mol Weight 462.41 g/mol
Molecular Formula C22H22O11
Exact Mass 462.116212 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BAmZoAz0kie
Name PHYLLODULCIN-3'-O-BETA-GLUCURONIDE
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H22O11
InChI InChI=1S/C22H22O11/c1-30-12-6-5-9(13-8-10-3-2-4-11(23)15(10)21(29)31-13)7-14(12)32-22-18(26)16(24)17(25)19(33-22)20(27)28/h2-7,13,16-19,22-26H,8H2,1H3,(H,27,28)/t13?,16-,17-,18+,19-,22+/m1/s1
InChIKey GZIKQVZOPMIRMI-CBYJIQGBSA-N
Literature Reference Author T.YASUDA,S.KAYABA,K.TAKAHASHI,T.NAKAZAWA,K.OHSAWA
Literature Reference Citation J.NAT.PROD.,67,1604(2004)
Literature Reference DOI 10.1021/np0400353
Molecular Weight 462.410 g/mol
Solvent CD3OD
Source File Reference UWMZ8023