KNApSAcK Metabolite C00047474
Metabolite
KNApSAcK Entry
| id | C00047474 |
|---|---|
| Name | Jatamanvaltrate K / (+)-Jatamanvaltrate K |
| CAS RN | 1134138-83-2 |
| Standard InChI | InChI=1S/C22H32O9/c1-12(2)6-18(25)30-17-8-16-15(9-28-14(5)24)10-29-21(20(16)22(17,27)11-23)31-19(26)7-13(3)4/h8,10,12-13,17,20-21,23,27H,6-7,9,11H2,1-5H3/t17-,20+,21-,22+/m0/s1 |
| Standard InChI (Main Layer) | InChI=1S/C22H32O9/c1-12(2)6-18(25)30-17-8-16-15(9-28-14(5)24)10-29-21(20(16)22(17,27)11-23)31-19(26)7-13(3)4/h8,10,12-13,17,20-21,23,27H,6-7,9,11H2,1-5H3 |
Cluster
| Phytochemical cluster | No. 36 |
|---|---|
| KCF-S cluster | No. 433 |
Link
ChEMBL
| By standard InChI | CHEMBL551356 |
|---|---|
| By standard InChI Main Layer | CHEMBL551356 |
KEGG
| By LinkDB |
|---|
CTD
| By CAS RN |
|---|
Species
Summary
Plant class
| class name | count |
|---|---|
| asterids | 1 |
Family
| family name | count |
|---|---|
| Caprifoliaceae | 1 |
List (1)
* NCBI
| KNApSAcK organism | *ID | *family | *plant class | *kingdom |
|---|---|---|---|---|
| Valeriana jatamansi | 59170 | Caprifoliaceae | asterids | Viridiplantae |