| SpectraBase Compound ID | FMad4d60GkM |
|---|---|
| InChI | InChI=1S/C51H52O23/c52-18-34-40(62)42(64)45(67)51(71-34)74-49-39(37-30(59)14-23(53)15-32(37)69-47(49)22-8-10-26(55)29(58)13-22)38-31(60)17-27(56)24-16-33(46(73-48(24)38)21-7-9-25(54)28(57)12-21)70-50-44(66)43(65)41(63)35(72-50)19-68-36(61)11-6-20-4-2-1-3-5-20/h1-15,17,33-35,39-47,49-60,62-67H,16,18-19H2/b11-6+/t33-,34+,35-,39+,40+,41-,42-,43+,44-,45+,46-,47-,49+,50-,51-/m1/s1 |
| InChIKey | YFQFTWJCXMZRGA-BDTJPYENSA-N |
| Mol Weight | 1033.0 g/mol |
| Molecular Formula | C51H52O23 |
| Exact Mass | 1032.289938 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 4ueQDiPwTVy |
|---|---|
| Name | CATECHIN-3-O-BETA-D-GLUCOPYRANO-(4-ALPHA->8)-EPICATECHIN-3-O-BETA-D-GLUCO-(6-CINNAMOYL)-PYRANOSIDE |
| Compound Number | 5 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C51H52O23 |
| InChI | InChI=1S/C51H52O23/c52-18-34-40(62)42(64)45(67)51(71-34)74-49-39(37-30(59)14-23(53)15-32(37)69-47(49)22-8-10-26(55)29(58)13-22)38-31(60)17-27(56)24-16-33(46(73-48(24)38)21-7-9-25(54)28(57)12-21)70-50-44(66)43(65)41(63)35(72-50)19-68-36(61)11-6-20-4-2-1-3-5-20/h1-15,17,33-35,39-47,49-60,62-67H,16,18-19H2/b11-6+/t33-,34+,35-,39+,40+,41-,42-,43+,44-,45+,46-,47-,49+,50-,51-/m1/s1 |
| InChIKey | YFQFTWJCXMZRGA-BDTJPYENSA-N |
| Literature Reference Author | J.LOKVAM,P.D.COLEY,T.A.KURSAR |
| Literature Reference Citation | PHYTOCHEM.,65,351(2004) |
| Literature Reference DOI | 10.1016/j.phytochem.2003.11.012 |
| Molecular Weight | 1032.960 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWVN31386 |