KNApSAcK Metabolite C00047472
Metabolite
KNApSAcK Entry
| id | C00047472 |
|---|---|
| Name | Jatamanvaltrate I / (-)-Jatamanvaltrate I |
| CAS RN | 1134138-78-5 |
| Standard InChI | InChI=1S/C29H36O11/c1-16(2)10-24(32)36-13-19-14-37-28(40-25(33)11-17(3)4)26-21(19)12-23(39-18(5)30)29(26,35)15-38-27(34)20-8-6-7-9-22(20)31/h6-9,12,14,16-17,23,26,28,31,35H,10-11,13,15H2,1-5H3/t23-,26+,28-,29+/m0/s1 |
| Standard InChI (Main Layer) | InChI=1S/C29H36O11/c1-16(2)10-24(32)36-13-19-14-37-28(40-25(33)11-17(3)4)26-21(19)12-23(39-18(5)30)29(26,35)15-38-27(34)20-8-6-7-9-22(20)31/h6-9,12,14,16-17,23,26,28,31,35H,10-11,13,15H2,1-5H3 |
Cluster
| Phytochemical cluster | No. 36 |
|---|---|
| KCF-S cluster | No. 433 |
Link
ChEMBL
| By standard InChI | CHEMBL551298 |
|---|---|
| By standard InChI Main Layer | CHEMBL551298 |
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 |