KNApSAcK Metabolite C00012860
Metabolite
KNApSAcK Entry
| id | C00012860 |
|---|---|
| Name | Odonticin / 1,2,3,4,4a,5,6,8a-Octahydro-7-(1-hydroperoxy-1-methylethyl)-1-hydroxy-1,4a-dimethyl-6-oxo-2-naphthalenyl ester 2,3-dihydroxy-2-methyl-butanoic acid |
| CAS RN | 122398-17-8 |
| Standard InChI | InChI=1S/C20H32O8/c1-11(21)19(5,24)16(23)27-15-7-8-18(4)10-13(22)12(17(2,3)28-26)9-14(18)20(15,6)25/h9,11,14-15,21,24-26H,7-8,10H2,1-6H3 |
| Standard InChI (Main Layer) | InChI=1S/C20H32O8/c1-11(21)19(5,24)16(23)27-15-7-8-18(4)10-13(22)12(17(2,3)28-26)9-14(18)20(15,6)25/h9,11,14-15,21,24-26H,7-8,10H2,1-6H3 |
Cluster
| Phytochemical cluster | |
|---|---|
| KCF-S cluster | No. 7219 |
Link
ChEMBL
| By standard InChI | |
|---|---|
| By standard InChI Main Layer |
KEGG
| By LinkDB |
|---|
CTD
| By CAS RN |
|---|
Species
Summary
Plant class
| class name | count |
|---|---|
| asterids | 1 |
Family
| family name | count |
|---|---|
| Asteraceae | 1 |
List (1)
* NCBI
| KNApSAcK organism | *ID | *family | *plant class | *kingdom |
|---|---|---|---|---|
| Pluchea arguta | 41623 | Asteraceae | asterids | Viridiplantae |