KNApSAcK Metabolite C00045256
Metabolite
KNApSAcK Entry
| id | C00045256 |
|---|---|
| Name | Cascarillin H / (-)-Cascarillin H |
| CAS RN | 453517-76-5 |
| Standard InChI | InChI=1S/C22H30O6/c1-12-15(26-13(2)23)9-20(3)17(5-6-18-21(20,4)28-18)22(12)10-16(27-19(22)24)14-7-8-25-11-14/h7-8,11-12,15-19,24H,5-6,9-10H2,1-4H3/t12-,15-,16?,17+,18-,19+,20-,21-,22-/m1/s1 |
| Standard InChI (Main Layer) | InChI=1S/C22H30O6/c1-12-15(26-13(2)23)9-20(3)17(5-6-18-21(20,4)28-18)22(12)10-16(27-19(22)24)14-7-8-25-11-14/h7-8,11-12,15-19,24H,5-6,9-10H2,1-4H3 |
Cluster
| Phytochemical cluster | No. 43 |
|---|---|
| KCF-S cluster | No. 1310 |
Link
ChEMBL
| By standard InChI | |
|---|---|
| By standard InChI Main Layer | CHEMBL2005858 |
KEGG
| By LinkDB |
|---|
CTD
| By CAS RN |
|---|
Species
Summary
Plant class
| class name | count |
|---|---|
| rosids | 1 |
Family
| family name | count |
|---|---|
| Euphorbiaceae | 1 |
List (1)
* NCBI
| KNApSAcK organism | *ID | *family | *plant class | *kingdom |
|---|---|---|---|---|
| Croton eluteria | 100370 | Euphorbiaceae | rosids | Viridiplantae |