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PETUNIOSIDE-D
SpectraBase Compound ID Jujzzjm3vCX
InChI InChI=1S/C34H54O10/c1-17(24(15-34(6,42)31(2,3)41)43-30-29(40)28(39)27(38)25(16-35)44-30)20-7-8-21-26-22(10-12-33(20,21)5)32(4)11-9-19(36)13-18(32)14-23(26)37/h9,11,13,17,20-30,35,37-42H,7-8,10,12,14-16H2,1-6H3/t17-,20?,21?,22?,23+,24-,25-,26?,27-,28+,29-,30-,32-,33+,34?/m0/s1
InChIKey ZVMFBTFEHMBRPO-WXAPHRHCSA-N
Mol Weight 622.8 g/mol
Molecular Formula C34H54O10
Exact Mass 622.371698 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID I4TLBgG1tfI
Name PETUNIOSIDE-D
Compound Number 6
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C34H54O10
InChI InChI=1S/C34H54O10/c1-17(24(15-34(6,42)31(2,3)41)43-30-29(40)28(39)27(38)25(16-35)44-30)20-7-8-21-26-22(10-12-33(20,21)5)32(4)11-9-19(36)13-18(32)14-23(26)37/h9,11,13,17,20-30,35,37-42H,7-8,10,12,14-16H2,1-6H3/t17-,20?,21?,22?,23+,24-,25-,26?,27-,28+,29-,30-,32-,33+,34?/m0/s1
InChIKey ZVMFBTFEHMBRPO-WXAPHRHCSA-N
Literature Reference Author K.SHINGU,H.FUJII,K.MIZUKI,I.UEDA,S.YAHARA,T.NOHARA
Literature Reference Citation PHYTOCHEM.,36,1307(1994)
Literature Reference DOI 10.1016/S0031-9422(00)89657-0
Molecular Weight 622.797 g/mol
Solvent C5D5N
Source File Reference UWLU26327