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6-O-[(6''-O-ALLOPHANYL)-BETA-D-GLUCOPYRANOSYL]-2,5-DIHYDROXY-7-PHENYLPHENALEN-1-ONE
SpectraBase Compound ID 9fXe2oqkK9q
InChI InChI=1S/C27H24N2O11/c28-26(36)29-27(37)38-10-17-21(33)22(34)23(35)25(39-17)40-24-16(31)9-12-8-15(30)20(32)14-7-6-13(19(24)18(12)14)11-4-2-1-3-5-11/h1-9,17,21-23,25,30-31,33-35H,10H2,(H3,28,29,36,37)/t17-,21-,22+,23-,25+/m1/s1
InChIKey UAZMCQYNPUKNOV-ZJHKXHAFSA-N
Mol Weight 552.49 g/mol
Molecular Formula C27H24N2O11
Exact Mass 552.13801 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GAAlDQsbbr9
Name 6-O-[(6''-O-ALLOPHANYL)-BETA-D-GLUCOPYRANOSYL]-2,5-DIHYDROXY-7-PHENYLPHENALEN-1-ONE
Compound Number 17
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C27H24N2O11
InChI InChI=1S/C27H24N2O11/c28-26(36)29-27(37)38-10-17-21(33)22(34)23(35)25(39-17)40-24-16(31)9-12-8-15(30)20(32)14-7-6-13(19(24)18(12)14)11-4-2-1-3-5-11/h1-9,17,21-23,25,30-31,33-35H,10H2,(H3,28,29,36,37)/t17-,21-,22+,23-,25+/m1/s1
InChIKey UAZMCQYNPUKNOV-ZJHKXHAFSA-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 552.494 g/mol
Solvent CD3OD
Source File Reference UWSI7013