KNApSAcK Metabolite C00012306
Metabolite
KNApSAcK Entry
| id | C00012306 |
|---|---|
| Name | Calein A |
| CAS RN | 63194-22-9 |
| Standard InChI | InChI=1S/C22H28O8/c1-7-12(3)20(25)30-18-17-13(4)21(26)29-15(17)10-11(2)8-9-16(24)22(6,27)19(18)28-14(5)23/h7-9,11,15,17-19,27H,4,10H2,1-3,5-6H3/b9-8-,12-7-/t11-,15+,17-,18-,19+,22-/m0/s1 |
| Standard InChI (Main Layer) | InChI=1S/C22H28O8/c1-7-12(3)20(25)30-18-17-13(4)21(26)29-15(17)10-11(2)8-9-16(24)22(6,27)19(18)28-14(5)23/h7-9,11,15,17-19,27H,4,10H2,1-3,5-6H3 |
Cluster
| Phytochemical cluster | |
|---|---|
| KCF-S cluster | No. 348 |
Link
ChEMBL
| By standard InChI | |
|---|---|
| By standard InChI Main Layer | CHEMBL2047550 |
KEGG
| By LinkDB |
|---|
CTD
| By CAS RN |
|---|
Species
Summary
Plant class
| class name | count |
|---|---|
| asterids | 2 |
Family
| family name | count |
|---|---|
| Asteraceae | 2 |
List (2)
* NCBI
| KNApSAcK organism | *ID | *family | *plant class | *kingdom |
|---|---|---|---|---|
| Calea zacatechichi | 183008 | Asteraceae | asterids | Viridiplantae |
| Calea zactechichi | 183008 | Asteraceae | asterids | Viridiplantae |