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HIPPOPHAENIN-A;2,3,4,6-DI-O-(S)-HEXAHYDROXYDIPHENOL-5-O-GALLOYLGLUCONIC-ACID

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HIPPOPHAENIN-A;2,3,4,6-DI-O-(S)-HEXAHYDROXYDIPHENOL-5-O-GALLOYLGLUCONIC-ACID
SpectraBase Compound ID C32jSY3DnY6
InChI InChI=1S/C41H28O27/c42-13-1-8(2-14(43)24(13)48)37(59)65-19-7-64-38(60)9-3-15(44)25(49)29(53)20(9)21-10(4-16(45)26(50)30(21)54)39(61)66-33(19)34-35(36(57)58)68-41(63)12-6-18(47)28(52)32(56)23(12)22-11(40(62)67-34)5-17(46)27(51)31(22)55/h1-6,19,33-35,42-56H,7H2,(H,57,58)/t19-,33+,34+,35-/m0/s1
InChIKey RBCBWTZJWLFGTN-ZMSYUBEUSA-N
Mol Weight 952.6 g/mol
Molecular Formula C41H28O27
Exact Mass 952.081796 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2KcTlX2hf9j
Name HIPPOPHAENIN-A;2,3,4,6-DI-O-(S)-HEXAHYDROXYDIPHENOL-5-O-GALLOYLGLUCONIC-ACID
Compound Number 13
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C41H28O27
InChI InChI=1S/C41H28O27/c42-13-1-8(2-14(43)24(13)48)37(59)65-19-7-64-38(60)9-3-15(44)25(49)29(53)20(9)21-10(4-16(45)26(50)30(21)54)39(61)66-33(19)34-35(36(57)58)68-41(63)12-6-18(47)28(52)32(56)23(12)22-11(40(62)67-34)5-17(46)27(51)31(22)55/h1-6,19,33-35,42-56H,7H2,(H,57,58)/t19-,33+,34+,35-/m0/s1
InChIKey RBCBWTZJWLFGTN-ZMSYUBEUSA-N
Literature Reference Author T.YOSHIDA,K.TANAKA,X.M.CHEN,T.OKUDA
Literature Reference Citation PHYTOCHEM.,30,663(1991)
Literature Reference DOI 10.1016/0031-9422(91)83748-A
Molecular Weight 952.657 g/mol
Solvent ACETONE-D6
Source File Reference UWLU32339