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MYRCIACITRIN-V;(2S)-6,8-DIMETHYL-5,7,2',5'-TETRAHYDROXY-FLAVANONE-7-O-(6''-O-PARA-HYDROXYBENZOYL)-BETA-D-GLUCOPYRANOSIDE
SpectraBase Compound ID s4OZdD3eDY
InChI InChI=1S/C30H30O13/c1-12-23(35)22-19(34)10-20(17-9-16(32)7-8-18(17)33)41-28(22)13(2)27(12)43-30-26(38)25(37)24(36)21(42-30)11-40-29(39)14-3-5-15(31)6-4-14/h3-9,20-21,24-26,30-33,35-38H,10-11H2,1-2H3/t20-,21-,24-,25+,26-,30+/m0/s1
InChIKey UNSZUCUHDNOPMN-HRBPNNINSA-N
Mol Weight 598.56 g/mol
Molecular Formula C30H30O13
Exact Mass 598.168641 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID K4qVY68TGUb
Name MYRCIACITRIN-V;(2S)-6,8-DIMETHYL-5,7,2',5'-TETRAHYDROXY-FLAVANONE-7-O-(6''-O-PARA-HYDROXYBENZOYL)-BETA-D-GLUCOPYRANOSIDE
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C30H30O13
InChI InChI=1S/C30H30O13/c1-12-23(35)22-19(34)10-20(17-9-16(32)7-8-18(17)33)41-28(22)13(2)27(12)43-30-26(38)25(37)24(36)21(42-30)11-40-29(39)14-3-5-15(31)6-4-14/h3-9,20-21,24-26,30-33,35-38H,10-11H2,1-2H3/t20-,21-,24-,25+,26-,30+/m0/s1
InChIKey UNSZUCUHDNOPMN-HRBPNNINSA-N
Literature Reference Author H.MATSUDA,N.NISHIDA,M.YOSHIKAWA
Literature Reference Citation CHEM.PHARM.BULL.,50,429(2002)
Literature Reference DOI 10.1248/cpb.50.429
Molecular Weight 598.560 g/mol
Solvent DMSO-D6
Source File Reference UWVN7961