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ARVENIN
SpectraBase Compound ID G7njk23jN9c
InChI InChI=1S/C36H56O12/c1-31(2,45)12-11-23(39)36(8,46)28-19(38)14-33(5)22-10-9-17-18(35(22,7)24(40)15-34(28,33)6)13-20(29(44)32(17,3)4)47-30-27(43)26(42)25(41)21(16-37)48-30/h9,18-22,25-28,30,37-38,41-43,45-46H,10-16H2,1-8H3/t18-,19-,20+,21+,22+,25+,26-,27+,28+,30+,33+,34-,35+,36?/m1/s1
InChIKey NWOBCRRKTPFKMK-NZFWWOHXSA-N
Mol Weight 680.8 g/mol
Molecular Formula C36H56O12
Exact Mass 680.377177 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Ij8bhwgSeXW
Name ARVENIN
Compound Number 8
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C36H56O12
InChI InChI=1S/C36H56O12/c1-31(2,45)12-11-23(39)36(8,46)28-19(38)14-33(5)22-10-9-17-18(35(22,7)24(40)15-34(28,33)6)13-20(29(44)32(17,3)4)47-30-27(43)26(42)25(41)21(16-37)48-30/h9,18-22,25-28,30,37-38,41-43,45-46H,10-16H2,1-8H3/t18-,19-,20+,21+,22+,25+,26-,27+,28+,30+,33+,34-,35+,36?/m1/s1
InChIKey NWOBCRRKTPFKMK-NZFWWOHXSA-N
Literature Reference Author S.FUJITA,R.KASAI,K.OHTANI,K.YAMASAKI,M.H.CHIU,R.L.NIE,O.TANA KA
Literature Reference Citation PHYTOCHEM.,38,465(1995)
Literature Reference DOI 10.1016/0031-9422(94)00608-V
Molecular Weight 680.833 g/mol
Solvent C5D5N
Source File Reference UWMS4787