| SpectraBase Compound ID | bveRAlhi4 |
|---|---|
| InChI | InChI=1S/C60H50O24/c61-23-13-33(70)42-40(14-23)82-57(20-2-6-26(63)30(67)10-20)53(78)48(42)44-37(74)18-41-47(52(44)77)50(55(80)58(83-41)21-3-7-27(64)31(68)11-21)46-35(72)16-34(71)45-49(54(79)59(84-60(45)46)22-4-8-28(65)32(69)12-22)43-36(73)17-39-24(51(43)76)15-38(75)56(81-39)19-1-5-25(62)29(66)9-19/h1-14,16-18,38,48-50,53-59,61-80H,15H2/t38-,48-,49-,50-,53-,54+,55+,56-,57-,58+,59+/m0/s1 |
| InChIKey | OZYBGUPTDWWHHF-KZUPATSASA-N |
| Mol Weight | 1155.0 g/mol |
| Molecular Formula | C60H50O24 |
| Exact Mass | 1154.269202 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | H9Wyu5eLNt1 |
|---|---|
| Name | EPICATECHIN-(1-BETA->6)-EPICATECHIN-(4-BETA->8)-EPICATECHIN-(4-BETA->6)-EPICATECHIN |
| Compound Number | 6 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C60H50O24 |
| InChI | InChI=1S/C60H50O24/c61-23-13-33(70)42-40(14-23)82-57(20-2-6-26(63)30(67)10-20)53(78)48(42)44-37(74)18-41-47(52(44)77)50(55(80)58(83-41)21-3-7-27(64)31(68)11-21)46-35(72)16-34(71)45-49(54(79)59(84-60(45)46)22-4-8-28(65)32(69)12-22)43-36(73)17-39-24(51(43)76)15-38(75)56(81-39)19-1-5-25(62)29(66)9-19/h1-14,16-18,38,48-50,53-59,61-80H,15H2/t38-,48-,49-,50-,53-,54+,55+,56-,57-,58+,59+/m0/s1 |
| InChIKey | OZYBGUPTDWWHHF-KZUPATSASA-N |
| Literature Reference Author | T.H.HWANG,Y.KASHIWADA,G.I.NONAKA,I.NISHIOKA |
| Literature Reference Citation | PHYTOCHEM.,29,279(1990) |
| Literature Reference DOI | 10.1016/0031-9422(90)89050-J |
| Molecular Weight | 1155.043 g/mol |
| Solvent | ACETONE-D6:D2O |
| Source File Reference | UWMZ25634 |