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GYMNOSIDE-IX;4'''-O-TRANS-CINNAMOYL-6'''-O-ACETYLDACTYLORHIN-A
SpectraBase Compound ID FM5h2f8qg10
InChI InChI=1S/C51H64O24/c1-26(2)19-51(50(65)68-24-30-11-16-32(17-12-30)70-48-44(63)41(60)39(58)34(22-53)72-48,20-37(56)67-23-29-9-14-31(15-10-29)69-47-43(62)40(59)38(57)33(21-52)71-47)75-49-45(64)42(61)46(35(73-49)25-66-27(3)54)74-36(55)18-13-28-7-5-4-6-8-28/h4-18,26,33-35,38-49,52-53,57-64H,19-25H2,1-3H3/b18-13+/t33-,34+,35-,38-,39+,40+,41-,42-,43-,44+,45-,46-,47-,48+,49+,51-/m0/s1
InChIKey VGDRWWNKEHJEQB-HOYYLZGJSA-N
Mol Weight 1061.0 g/mol
Molecular Formula C51H64O24
Exact Mass 1060.378753 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3FLF6wtdb4k
Name GYMNOSIDE-IX;4'''-O-TRANS-CINNAMOYL-6'''-O-ACETYLDACTYLORHIN-A
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C51H64O24
InChI InChI=1S/C51H64O24/c1-26(2)19-51(50(65)68-24-30-11-16-32(17-12-30)70-48-44(63)41(60)39(58)34(22-53)72-48,20-37(56)67-23-29-9-14-31(15-10-29)69-47-43(62)40(59)38(57)33(21-52)71-47)75-49-45(64)42(61)46(35(73-49)25-66-27(3)54)74-36(55)18-13-28-7-5-4-6-8-28/h4-18,26,33-35,38-49,52-53,57-64H,19-25H2,1-3H3/b18-13+/t33-,34+,35-,38-,39+,40+,41-,42-,43-,44+,45-,46-,47-,48+,49+,51-/m0/s1
InChIKey VGDRWWNKEHJEQB-HOYYLZGJSA-N
Literature Reference Author T.MORIKAWA,H.XIE,H.MATSUDA,T.WANG,M.YOSHIKAWA
Literature Reference Citation CHEM.PHARM.BULL.,54,506(2006)
Literature Reference DOI 10.1248/cpb.54.506
Molecular Weight 1061.055 g/mol
Sample ID 36959
Solvent C5D5N