KNApSAcK Metabolite C00009243
Metabolite
KNApSAcK Entry
| id | C00009243 |
|---|---|
| Name | Catechin-(4alpha->8)-catechin-3-O-(1-hydroxy-6-oxo-2-cyclohexene-1-carboxylate) |
| CAS RN | |
| Standard InChI | InChI=1S/C37H32O15/c38-17-11-24(44)29-26(12-17)50-34(16-5-7-20(40)23(43)10-16)32(47)31(29)30-25(45)14-21(41)18-13-27(51-36(48)37(49)8-2-1-3-28(37)46)33(52-35(18)30)15-4-6-19(39)22(42)9-15/h2,4-12,14,27,31-34,38-45,47,49H,1,3,13H2/t27-,31-,32-,33+,34+,37?/m0/s1 |
| Standard InChI (Main Layer) | InChI=1S/C37H32O15/c38-17-11-24(44)29-26(12-17)50-34(16-5-7-20(40)23(43)10-16)32(47)31(29)30-25(45)14-21(41)18-13-27(51-36(48)37(49)8-2-1-3-28(37)46)33(52-35(18)30)15-4-6-19(39)22(42)9-15/h2,4-12,14,27,31-34,38-45,47,49H,1,3,13H2 |
Cluster
| Phytochemical cluster | No. 19 |
|---|---|
| KCF-S cluster | No. 29 |
Link
ChEMBL
| By standard InChI | |
|---|---|
| By standard InChI Main Layer |
KEGG
| By LinkDB |
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CTD
| By CAS RN |
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Species
Summary
Plant class
| class name | count |
|---|---|
| rosids | 1 |
Family
| family name | count |
|---|---|
| Salicaceae | 1 |
List (1)
* NCBI
| KNApSAcK organism | *ID | *family | *plant class | *kingdom |
|---|---|---|---|---|
| Salix sieboldiana | 40685 | Salicaceae | rosids | Viridiplantae |