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NEOHANCOSIDE-C-HEXAACETATE

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NEOHANCOSIDE-C-HEXAACETATE
SpectraBase Compound ID 4pvCm692if
InChI InChI=1S/C31H38O17/c1-14(32)21-10-8-9-11-22(21)47-31-29(46-20(7)38)27(44-18(5)36)25(42-16(3)34)24(48-31)13-40-30-28(45-19(6)37)26(43-17(4)35)23(12-39-30)41-15(2)33/h8-11,23-31H,12-13H2,1-7H3/t23-,24+,25+,26+,27-,28-,29+,30+,31+/m0/s1
InChIKey UBQSMFCJJYKPPQ-NMYXKLMNSA-N
Mol Weight 682.6 g/mol
Molecular Formula C31H38O17
Exact Mass 682.2109 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LDRaUCkmkHt
Name NEOHANCOSIDE-C-HEXAACETATE
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C31H38O17
InChI InChI=1S/C31H38O17/c1-14(32)21-10-8-9-11-22(21)47-31-29(46-20(7)38)27(44-18(5)36)25(42-16(3)34)24(48-31)13-40-30-28(45-19(6)37)26(43-17(4)35)23(12-39-30)41-15(2)33/h8-11,23-31H,12-13H2,1-7H3/t23-,24+,25+,26+,27-,28-,29+,30+,31+/m0/s1
InChIKey UBQSMFCJJYKPPQ-NMYXKLMNSA-N
Literature Reference Author H.LOU,X.LI,M.ONDA,Y.KONDA,T.MACHIDA,Y.TODA,T.HARIGAYA
Literature Reference Citation J.NAT.PROD.,56,1437(1993)
Literature Reference DOI 10.1021/np50099a001
Molecular Weight 682.633 g/mol
Solvent CDCl3
Source File Reference UWTS2238