| SpectraBase Compound ID | CTEk2fDOGCm |
|---|---|
| InChI | InChI=1S/2C41H32O26/c2*42-17-1-13(2-18(43)28(17)52)37(57)64-32-23(48)7-12(8-24(32)49)36(56)62-11-27-31(55)34(66-39(59)15-5-21(46)30(54)22(47)6-15)35(41(61)63-27)67-40(60)16-9-25(50)33(26(51)10-16)65-38(58)14-3-19(44)29(53)20(45)4-14/h2*1-10,27,31,34-35,41-55,61H,11H2/t27-,31+,34-,35+,41-;27-,31-,34+,35-,41+/m01/s1 |
| InChIKey | TVONSZASGLYWQL-JWZIJKEESA-N |
| Mol Weight | 1881.4 g/mol |
| Molecular Formula | C82H64O52 |
| Exact Mass | 1880.236362 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | CFYiMave4sD |
|---|---|
| Name | 2,6-BIS-O-DIGALLOYL-3-O-GALLOYL-D-GLUCOPYRANOSE |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C82H64O52 |
| InChI | InChI=1S/2C41H32O26/c2*42-17-1-13(2-18(43)28(17)52)37(57)64-32-23(48)7-12(8-24(32)49)36(56)62-11-27-31(55)34(66-39(59)15-5-21(46)30(54)22(47)6-15)35(41(61)63-27)67-40(60)16-9-25(50)33(26(51)10-16)65-38(58)14-3-19(44)29(53)20(45)4-14/h2*1-10,27,31,34-35,41-55,61H,11H2/t27-,31+,34-,35+,41-;27-,31-,34+,35-,41+/m01/s1 |
| InChIKey | TVONSZASGLYWQL-JWZIJKEESA-N |
| Literature Reference Author | F.E.KANDIL,N.H.EL-SAYED,H.N.MICHEAL,M.S.ISHAK,T.J.MABRY |
| Literature Reference Citation | PHYTOCHEM.,42,1243(1996) |
| Literature Reference DOI | 10.1016/0031-9422(95)00924-8 |
| Molecular Weight | 1881.379 g/mol |
| Solvent | ACETONE-D6 |
| Source File Reference | UWSI20523 |