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(8E)-NUEZHENIDE
SpectraBase Compound ID KZA2aGkI4YN
InChI InChI=1S/C31H42O17/c1-3-16-17(18(28(41)42-2)12-45-29(16)48-31-27(40)24(37)22(35)19(11-32)46-31)10-21(34)44-13-20-23(36)25(38)26(39)30(47-20)43-9-8-14-4-6-15(33)7-5-14/h3-7,12,17,19-20,22-27,29-33,35-40H,8-11,13H2,1-2H3/b16-3+/t17-,19-,20-,22-,23-,24+,25+,26-,27-,29-,30-,31+/m0/s1
InChIKey STKUCSFEBXPTAY-LMBXJFSTSA-N
Mol Weight 686.7 g/mol
Molecular Formula C31H42O17
Exact Mass 686.2422 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1Od3ZfymtC7
Name (8E)-NUEZHENIDE
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C31H42O17
InChI InChI=1S/C31H42O17/c1-3-16-17(18(28(41)42-2)12-45-29(16)48-31-27(40)24(37)22(35)19(11-32)46-31)10-21(34)44-13-20-23(36)25(38)26(39)30(47-20)43-9-8-14-4-6-15(33)7-5-14/h3-7,12,17,19-20,22-27,29-33,35-40H,8-11,13H2,1-2H3/b16-3+/t17-,19-,20-,22-,23-,24+,25+,26-,27-,29-,30-,31+/m0/s1
InChIKey STKUCSFEBXPTAY-LMBXJFSTSA-N
Literature Reference Author K.MACHIDA,A.KANEKO,T.HOSOGAI,R.KAKUDA,Y.YAOITA,M.KIKUCHI
Literature Reference Citation CHEM.PHARM.BULL.,50,493(2002)
Literature Reference DOI 10.1248/cpb.50.493
Molecular Weight 686.664 g/mol
Solvent CD3OD
Source File Reference UWVN7992