KNApSAcK Metabolite C00049939
Metabolite
KNApSAcK Entry
| id | C00049939 |
|---|---|
| Name | 2'-Epicycloisobrachycoumarinone epoxide / (-)-2'-Epicycloisobrachycoumarinone epoxide |
| CAS RN | 190062-43-2 |
| Standard InChI | InChI=1S/C20H22O5/c1-10-7-6-8-13-14(10)16-15(18(22)24-13)20(5,11(2)23-16)9-12(21)17-19(3,4)25-17/h6-8,11,17H,9H2,1-5H3/t11-,17?,20+/m0/s1 |
| Standard InChI (Main Layer) | InChI=1S/C20H22O5/c1-10-7-6-8-13-14(10)16-15(18(22)24-13)20(5,11(2)23-16)9-12(21)17-19(3,4)25-17/h6-8,11,17H,9H2,1-5H3 |
Cluster
| Phytochemical cluster | |
|---|---|
| KCF-S cluster | No. 1081 |
Link
ChEMBL
| By standard InChI | |
|---|---|
| By standard InChI Main Layer | CHEMBL465559 CHEMBL517042 |
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 |
|---|---|---|---|---|
| Vernonia brachycalyx | 434693 | Asteraceae | asterids | Viridiplantae |