![[EPICATECHIN-(4-BETA->8)]3-EPICATECHIN](/api/spectrum/JX7r3TCP46F/structure.png?h=300&w=458 "[EPICATECHIN-(4-BETA->8)]3-EPICATECHIN")
| SpectraBase Compound ID | BqIu9Fao1e9 |
|---|---|
| InChI | InChI=1S/C60H50O24/c61-23-13-34(71)42-41(14-23)81-55(20-2-6-26(63)31(68)10-20)51(78)48(42)44-36(73)17-38(75)46-50(53(80)57(83-59(44)46)22-4-8-28(65)33(70)12-22)47-39(76)18-37(74)45-49(52(79)56(84-60(45)47)21-3-7-27(64)32(69)11-21)43-35(72)16-29(66)24-15-40(77)54(82-58(24)43)19-1-5-25(62)30(67)9-19/h1-14,16-18,40,48-57,61-80H,15H2/t40-,48-,49+,50-,51-,52-,53-,54-,55-,56-,57-/m1/s1 |
| InChIKey | QFLMUASKTWGRQE-JNIIMKSASA-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 | JX7r3TCP46F |
|---|---|
| Name | [EPICATECHIN-(4-BETA->8)]3-EPICATECHIN |
| Compound Number | 7 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C60H50O24 |
| InChI | InChI=1S/C60H50O24/c61-23-13-34(71)42-41(14-23)81-55(20-2-6-26(63)31(68)10-20)51(78)48(42)44-36(73)17-38(75)46-50(53(80)57(83-59(44)46)22-4-8-28(65)33(70)12-22)47-39(76)18-37(74)45-49(52(79)56(84-60(45)47)21-3-7-27(64)32(69)11-21)43-35(72)16-29(66)24-15-40(77)54(82-58(24)43)19-1-5-25(62)30(67)9-19/h1-14,16-18,40,48-57,61-80H,15H2/t40-,48-,49+,50-,51-,52-,53-,54-,55-,56-,57-/m1/s1 |
| InChIKey | QFLMUASKTWGRQE-JNIIMKSASA-N |
| Literature Reference Author | L.J.PORTER,Z.MA,B.G.CHAN |
| Literature Reference Citation | PHYTOCHEM.,30,1657(1991) |
| Literature Reference DOI | 10.1016/0031-9422(91)84228-K |
| Molecular Weight | 1155.043 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWLU27509 |