KNApSAcK Metabolite C00022666
Metabolite
KNApSAcK Entry
| id | C00022666 |
|---|---|
| Name | 3beta-Angeloyloxyisocostic acid methyl ester |
| CAS RN | 112823-79-7 |
| Standard InChI | InChI=1S/C21H30O4/c1-7-13(2)19(22)25-18-9-11-21(5)10-8-16(12-17(21)15(18)4)14(3)20(23)24-6/h7,16,18H,3,8-12H2,1-2,4-6H3/b13-7-/t16-,18+,21+/m1/s1 |
| Standard InChI (Main Layer) | InChI=1S/C21H30O4/c1-7-13(2)19(22)25-18-9-11-21(5)10-8-16(12-17(21)15(18)4)14(3)20(23)24-6/h7,16,18H,3,8-12H2,1-2,4-6H3 |
Cluster
| Phytochemical cluster | |
|---|---|
| KCF-S cluster | No. 1851 |
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 |
|---|---|---|---|---|
| Eriocephalus pauperrimus | 99049 | Asteraceae | asterids | Viridiplantae |