KNApSAcK Metabolite C00009206
Metabolite
KNApSAcK Entry
| id | C00009206 |
|---|---|
| Name | 3-O-Galloylepicatechin-(4beta->6)-catechin |
| CAS RN | 106533-59-9 |
| Standard InChI | InChI=1S/C37H30O16/c38-16-9-22(43)29-28(10-16)52-35(14-2-4-19(40)21(42)6-14)36(53-37(50)15-7-24(45)33(49)25(46)8-15)31(29)30-23(44)12-27-17(32(30)48)11-26(47)34(51-27)13-1-3-18(39)20(41)5-13/h1-10,12,26,31,34-36,38-49H,11H2/t26-,31+,34+,35+,36+/m0/s1 |
| Standard InChI (Main Layer) | InChI=1S/C37H30O16/c38-16-9-22(43)29-28(10-16)52-35(14-2-4-19(40)21(42)6-14)36(53-37(50)15-7-24(45)33(49)25(46)8-15)31(29)30-23(44)12-27-17(32(30)48)11-26(47)34(51-27)13-1-3-18(39)20(41)5-13/h1-10,12,26,31,34-36,38-49H,11H2 |
Cluster
| Phytochemical cluster | No. 19 |
|---|---|
| KCF-S cluster | No. 29 |
Link
ChEMBL
| By standard InChI | |
|---|---|
| By standard InChI Main Layer |
KEGG
| By LinkDB |
|---|
CTD
| By CAS RN |
|---|
Species
Summary
Plant class
| class name | count |
|---|---|
| eudicotyledons | 1 |
| rosids | 1 |
Family
| family name | count |
|---|---|
| Polygonaceae | 1 |
| Vitaceae | 1 |
List (2)
* NCBI
| KNApSAcK organism | *ID | *family | *plant class | *kingdom |
|---|---|---|---|---|
| Rheum sp. | 3620 | Polygonaceae | eudicotyledons | Viridiplantae |
| Vitis vinifera | 29760 | Vitaceae | rosids | Viridiplantae |