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PNEUMATOPTERIN-C;(2S,4R)-5-BETA-D-GLUCOPYRANOSYLOXY-7-HYDROXY-6-HYDROXYMETHYL-8-METHYL-4,2''-OXOFLAVAN

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PNEUMATOPTERIN-C;(2S,4R)-5-BETA-D-GLUCOPYRANOSYLOXY-7-HYDROXY-6-HYDROXYMETHYL-8-METHYL-4,2''-OXOFLAVAN
SpectraBase Compound ID 4xl9wL6i5Xh
InChI InChI=1S/C23H26O9/c1-10-17(26)12(8-24)21-16-14(7-13(29-20(10)16)11-5-3-2-4-6-11)30-22-19(28)18(27)15(9-25)31-23(22)32-21/h2-6,13-15,18-19,22-28H,7-9H2,1H3/t13-,14+,15+,18+,19-,22+,23-/m1/s1
InChIKey RKHLARJOUBMHOH-MCJMQDROSA-N
Mol Weight 446.45 g/mol
Molecular Formula C23H26O9
Exact Mass 446.157682 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID pZDHwyTzoM
Name PNEUMATOPTERIN-C;(2S,4R)-5-BETA-D-GLUCOPYRANOSYLOXY-7-HYDROXY-6-HYDROXYMETHYL-8-METHYL-4,2''-OXOFLAVAN
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C23H26O9
InChI InChI=1S/C23H26O9/c1-10-17(26)12(8-24)21-16-14(7-13(29-20(10)16)11-5-3-2-4-6-11)30-22-19(28)18(27)15(9-25)31-23(22)32-21/h2-6,13-15,18-19,22-28H,7-9H2,1H3/t13-,14+,15+,18+,19-,22+,23-/m1/s1
InChIKey RKHLARJOUBMHOH-MCJMQDROSA-N
Literature Reference Author N.TANAKA,T.USHIODA,H.FUCHINO,J.E.BRAGGINS
Literature Reference Citation AUSTR.J.CHEM.,50,329(1997)
Literature Reference DOI 10.1071/C96108
Molecular Weight 446.454 g/mol
Solvent C5D5N
Source File Reference UWCS15725