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6-O-[(6''-O-ALLOPHANYL)-BETA-D-GLUCOPYRANOSYL]-5-METHOXY-7-PHENYL-3H-BENZO-[DE]-ISOCHROMEN-1-ONE
SpectraBase Compound ID GsfRgsMey6O
InChI InChI=1S/C27H26N2O11/c1-36-16-9-13-10-37-24(33)15-8-7-14(12-5-3-2-4-6-12)19(18(13)15)23(16)40-25-22(32)21(31)20(30)17(39-25)11-38-27(35)29-26(28)34/h2-9,17,20-22,25,30-32H,10-11H2,1H3,(H3,28,29,34,35)/t17-,20-,21+,22-,25+/m1/s1
InChIKey PQDBGWUPROQGSM-FHBCLOHASA-N
Mol Weight 554.51 g/mol
Molecular Formula C27H26N2O11
Exact Mass 554.15366 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5fsMDlf3GNg
Name 6-O-[(6''-O-ALLOPHANYL)-BETA-D-GLUCOPYRANOSYL]-5-METHOXY-7-PHENYL-3H-BENZO-[DE]-ISOCHROMEN-1-ONE
Compound Number 16
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C27H26N2O11
InChI InChI=1S/C27H26N2O11/c1-36-16-9-13-10-37-24(33)15-8-7-14(12-5-3-2-4-6-12)19(18(13)15)23(16)40-25-22(32)21(31)20(30)17(39-25)11-38-27(35)29-26(28)34/h2-9,17,20-22,25,30-32H,10-11H2,1H3,(H3,28,29,34,35)/t17-,20-,21+,22-,25+/m1/s1
InChIKey PQDBGWUPROQGSM-FHBCLOHASA-N
Literature Reference Author S.OPITZ,D.HOELSCHER,N.J.OLDHAM,S.BARTRAM,B.SCHNEIDER
Literature Reference Citation J.NAT.PROD.,65,1122(2002)
Literature Reference DOI 10.1021/np020083s
Molecular Weight 554.510 g/mol
Solvent CD3OD
Source File Reference UWSI7012