KNApSAcK Metabolite C00047471
Metabolite
KNApSAcK Entry
| id | C00047471 |
|---|---|
| Name | Jatamanvaltrate H / (-)-Jatamanvaltrate H |
| CAS RN | 1134138-76-3 |
| Standard InChI | InChI=1S/C22H34O9/c1-12(2)6-18(25)28-9-15-10-29-21(31-19(26)7-13(3)4)20-16(15)8-17(30-14(5)24)22(20,27)11-23/h10,12-13,16-17,20-21,23,27H,6-9,11H2,1-5H3/t16-,17+,20-,21+,22-/m1/s1 |
| Standard InChI (Main Layer) | InChI=1S/C22H34O9/c1-12(2)6-18(25)28-9-15-10-29-21(31-19(26)7-13(3)4)20-16(15)8-17(30-14(5)24)22(20,27)11-23/h10,12-13,16-17,20-21,23,27H,6-9,11H2,1-5H3 |
Cluster
| Phytochemical cluster | No. 36 |
|---|---|
| KCF-S cluster | No. 1308 |
Link
ChEMBL
| By standard InChI | CHEMBL559515 |
|---|---|
| By standard InChI Main Layer | CHEMBL559515 |
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 |