| Record Information |
|---|
| Version | 1.0 |
|---|
| Created at | 2023-04-11 00:00:00 UTC |
|---|
| Updated at | 2023-04-11 00:00:00 UTC |
|---|
| RI-Pred ID | RI01687036 |
|---|
|
| Compound Identification |
|---|
| Common Name | Epicatechin-(4beta->8)-catechin 3-gallate,2TMS,isomer#8 |
|---|
| Structure | |
|---|
| Average Molecular Weight | 874.2324 |
|---|
| SMILES | C[Si](C)(C)OC1=C(O)C=C(C(=O)O[C@H]2[C@@H](C3=CC=C(O)C(O)=C3)OC3=CC(O)=CC(O)=C3[C@@H]2C2=C(O)C=C(O)C3=C2O[C@H](C2=CC=C(O)C(O)=C2)[C@@H](O[Si](C)(C)C)C3)C=C1O |
|---|
|
| Physical Properties |
|---|
| Predicted Properties | | Property | Value | Reference |
|---|
| Retention Index | 9925.175 |
|
|---|
|
| References |
|---|
| General References | Accurate Prediction of Gas Chromatographic Kováts Retention Indices |
|---|