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STACHYSOSIDE_H;MELITTOSIDE_2''-O-PARA-(E)-COUMAROYLESTER
SpectraBase Compound ID HCArW1oP5kr
InChI InChI=1S/C30H38O17/c31-10-14-9-18(35)30(7-8-42-27(20(14)30)46-28-25(41)23(39)21(37)16(11-32)43-28)47-29-26(24(40)22(38)17(12-33)44-29)45-19(36)6-3-13-1-4-15(34)5-2-13/h1-9,16-18,20-29,31-35,37-41H,10-12H2/b6-3+/t16-,17+,18+,20-,21-,22+,23+,24-,25-,26+,27-,28+,29-,30+/m0/s1
InChIKey HONPFKTXDIQEGI-GDENXVELSA-N
Mol Weight 670.6 g/mol
Molecular Formula C30H38O17
Exact Mass 670.2109 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GqiJTZAKrmJ
Name (E)-STACHYSOSIDE-H
Compound Number 23
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C30H38O17
InChI InChI=1S/C30H38O17/c31-10-14-9-18(35)30(7-8-42-27(20(14)30)46-28-25(41)23(39)21(37)16(11-32)43-28)47-29-26(24(40)22(38)17(12-33)44-29)45-19(36)6-3-13-1-4-15(34)5-2-13/h1-9,16-18,20-29,31-35,37-41H,10-12H2/b6-3+/t16-,17+,18+,20-,21-,22+,23+,24-,25-,26+,27-,28+,29-,30+/m0/s1
InChIKey HONPFKTXDIQEGI-GDENXVELSA-N
Literature Reference Author B.DINDA,D.R.CHOWDHURY,B.C.MOHANTA
Literature Reference Citation CHEM.PHARM.BULL.,57,765(2009)
Literature Reference DOI 10.1248/cpb.57.765
Molecular Weight 670.622 g/mol
Sample ID 2623
Solvent CD3OD