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#2;ALTERPORRIOL-S;(1S*,1'S*,2R*,2'R*,3S*,3'S*,4S*,4'S*)-1,1',2,2'3,3',5,5'-OCTAHYDROXY-7,7'-DIMETHOXY-2,2'-DIMETHYL-1,1',2,2',3,3',4,4'-OCTAHYDRO-[4,4'-BIANTHR
SpectraBase Compound ID 8igmW3bLJ91
InChI InChI=1S/C32H30O14/c1-31(43)27(39)19(17-21(29(31)41)23(35)11-5-9(45-3)7-13(33)15(11)25(17)37)20-18-22(30(42)32(2,44)28(20)40)24(36)12-6-10(46-4)8-14(34)16(12)26(18)38/h5-8,19-20,27-30,33-34,39-44H,1-4H3/t19-,20-,27+,28+,29+,30+,31+,32+/m1/s1
InChIKey WWOFACZMDGHQHR-XOKUVSGRSA-N
Mol Weight 638.6 g/mol
Molecular Formula C32H30O14
Exact Mass 638.163556 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2R70eUXsIjl
Name #2;ALTERPORRIOL-S;(1S*,1'S*,2R*,2'R*,3S*,3'S*,4S*,4'S*)-1,1',2,2'3,3',5,5'-OCTAHYDROXY-7,7'-DIMETHOXY-2,2'-DIMETHYL-1,1',2,2',3,3',4,4'-OCTAHYDRO-[4,4'-BIANTHR
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C32H30O14
InChI InChI=1S/C32H30O14/c1-31(43)27(39)19(17-21(29(31)41)23(35)11-5-9(45-3)7-13(33)15(11)25(17)37)20-18-22(30(42)32(2,44)28(20)40)24(36)12-6-10(46-4)8-14(34)16(12)26(18)38/h5-8,19-20,27-30,33-34,39-44H,1-4H3/t19-,20-,27+,28+,29+,30+,31+,32+/m1/s1
InChIKey WWOFACZMDGHQHR-XOKUVSGRSA-N
Literature Reference Author B.CHEN,Q.SHEN,X.ZHU,Y.LIN
Literature Reference Citation MOLECULES,19,16529(2014)
Literature Reference DOI 10.3390/molecules191016529
Molecular Weight 638.582 g/mol
Solvent DMSO-D6
Source File Reference UWLU81489