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CNIDIMOSIDE-A;5,7-DIHYDROXY-6-[(2Z)-3-BETA-D-GLUCOPYRANOSYL-METHYL-2-BUTENYL]-2-METHYL-4H-[1]-BENZOPYRAN-4-ONE
SpectraBase Compound ID Ban1dRUFDy4
InChI InChI=1S/C21H26O10/c1-9(8-29-21-20(28)19(27)18(26)15(7-22)31-21)3-4-11-12(23)6-14-16(17(11)25)13(24)5-10(2)30-14/h3,5-6,15,18-23,25-28H,4,7-8H2,1-2H3/b9-3-/t15-,18-,19+,20-,21-/m0/s1
InChIKey VZTJAPXJLBMTAU-AQPZAQQISA-N
Mol Weight 438.43 g/mol
Molecular Formula C21H26O10
Exact Mass 438.152597 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2hvIryIeZt3
Name CNIDIMOSIDE-A;5,7-DIHYDROXY-6-[(2Z)-3-BETA-D-GLUCOPYRANOSYL-METHYL-2-BUTENYL]-2-METHYL-4H-[1]-BENZOPYRAN-4-ONE
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H26O10
InChI InChI=1S/C21H26O10/c1-9(8-29-21-20(28)19(27)18(26)15(7-22)31-21)3-4-11-12(23)6-14-16(17(11)25)13(24)5-10(2)30-14/h3,5-6,15,18-23,25-28H,4,7-8H2,1-2H3/b9-3-/t15-,18-,19+,20-,21-/m0/s1
InChIKey VZTJAPXJLBMTAU-AQPZAQQISA-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 438.431 g/mol
Solvent DMSO-D6
Source File Reference UWLU24169