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7-(3',4'-DI-O-ACETYL)-CAFFEOYL-1,2,3,4,6-PENTA-O-ACETYL-BETA-D-ALTRO-HEPTULOFURANOSE
SpectraBase Compound ID I99iP2BZ2Fh
InChI InChI=1S/C30H34O17/c1-15(31)40-14-30(46-21(7)37)29(45-20(6)36)28(44-19(5)35)27(47-30)25(43-18(4)34)13-39-26(38)11-9-22-8-10-23(41-16(2)32)24(12-22)42-17(3)33/h8-12,25,27-29H,13-14H2,1-7H3/b11-9+/t25?,27-,28-,29+,30-/m1/s1
InChIKey UNSHZCSLDMESEY-MQEMYWAOSA-N
Mol Weight 666.6 g/mol
Molecular Formula C30H34O17
Exact Mass 666.1796 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GOR4vr4Kek
Name 7-(3',4'-DI-O-ACETYL)-CAFFEOYL-1,2,3,4,6-PENTA-O-ACETYL-BETA-D-ALTRO-HEPTULOFURANOSE
Compound Number 1A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C30H34O17
InChI InChI=1S/C30H34O17/c1-15(31)40-14-30(46-21(7)37)29(45-20(6)36)28(44-19(5)35)27(47-30)25(43-18(4)34)13-39-26(38)11-9-22-8-10-23(41-16(2)32)24(12-22)42-17(3)33/h8-12,25,27-29H,13-14H2,1-7H3/b11-9+/t25?,27-,28-,29+,30-/m1/s1
InChIKey UNSHZCSLDMESEY-MQEMYWAOSA-N
Literature Reference Author X.C.LI,H.N.ELSOHLY,A.M.CLARK
Literature Reference Citation PHYTOCHEM.,53,1033(2000)
Literature Reference DOI 10.1016/S0031-9422(99)00435-5
Molecular Weight 666.590 g/mol
Solvent CDCl3
Source File Reference UWLU2292