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CNIDIMOSIDE-A-HEXAACETATE

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CNIDIMOSIDE-A-HEXAACETATE
SpectraBase Compound ID HP1wRx2RKoh
InChI InChI=1S/C33H38O16/c1-15(9-10-23-25(44-18(4)35)12-26-28(29(23)45-19(5)36)24(40)11-16(2)43-26)13-42-33-32(48-22(8)39)31(47-21(7)38)30(46-20(6)37)27(49-33)14-41-17(3)34/h9,11-12,27,30-33H,10,13-14H2,1-8H3/b15-9-/t27-,30-,31+,32-,33-/m0/s1
InChIKey CVCMZYAOTZZFKR-GLJFGMJVSA-N
Mol Weight 690.7 g/mol
Molecular Formula C33H38O16
Exact Mass 690.215985 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IH8NTxYvBUb
Name CNIDIMOSIDE-A-HEXAACETATE
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C33H38O16
InChI InChI=1S/C33H38O16/c1-15(9-10-23-25(44-18(4)35)12-26-28(29(23)45-19(5)36)24(40)11-16(2)43-26)13-42-33-32(48-22(8)39)31(47-21(7)38)30(46-20(6)37)27(49-33)14-41-17(3)34/h9,11-12,27,30-33H,10,13-14H2,1-8H3/b15-9-/t27-,30-,31+,32-,33-/m0/s1
InChIKey CVCMZYAOTZZFKR-GLJFGMJVSA-N
Literature Reference Author K.BABA,H.KAWANISHI,M.TANIGUCHI,M.KOZAWA
Literature Reference Citation PHYTOCHEM.,35,221(1994)
Literature Reference DOI 10.1016/s0031-9422(00)90538-7
Molecular Weight 690.655 g/mol
Solvent DMSO-D6
Source File Reference UWLU24176