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ROZGXKOKKRMWMT-QCGWAOTDSA-N
SpectraBase Compound ID AcXzxyVopTX
InChI InChI=1S/C36H48O21/c1-50-20-11-15(3-6-18(20)40)4-7-24(42)52-14-23-27(45)32(56-34-30(48)28(46)25(43)21(12-37)53-34)33(57-35-31(49)29(47)26(44)22(13-38)54-35)36(55-23)51-9-8-16-2-5-17(39)19(41)10-16/h2-7,10-11,21-23,25-41,43-49H,8-9,12-14H2,1H3/b7-4+/t21-,22+,23-,25-,26+,27-,28+,29-,30-,31+,32+,33-,34+,35-,36-/m0/s1
InChIKey ROZGXKOKKRMWMT-QCGWAOTDSA-N
Mol Weight 816.8 g/mol
Molecular Formula C36H48O21
Exact Mass 816.268809 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GmPzSjc5gBN
Name ROZGXKOKKRMWMT-QCGWAOTDSA-N
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C36H48O21
InChI InChI=1S/C36H48O21/c1-50-20-11-15(3-6-18(20)40)4-7-24(42)52-14-23-27(45)32(56-34-30(48)28(46)25(43)21(12-37)53-34)33(57-35-31(49)29(47)26(44)22(13-38)54-35)36(55-23)51-9-8-16-2-5-17(39)19(41)10-16/h2-7,10-11,21-23,25-41,43-49H,8-9,12-14H2,1H3/b7-4+/t21-,22+,23-,25-,26+,27-,28+,29-,30-,31+,32+,33-,34+,35-,36-/m0/s1
InChIKey ROZGXKOKKRMWMT-QCGWAOTDSA-N
Literature Reference Author H.AOSHIMA,T.MIYASE,A.UENO
Literature Reference Citation PHYTOCHEM.,37,547(1994)
Literature Reference DOI 10.1016/0031-9422(94)85097-6
Molecular Weight 816.765 g/mol
Solvent CD3OD
Source File Reference UWMS23022