KNApSAcK Metabolite C00022072
Metabolite
KNApSAcK Entry
| id | C00022072 |
|---|---|
| Name | Ligantrol monoacetate |
| CAS RN | 53198-14-4 |
| Standard InChI | InChI=1S/C22H38O6/c1-16(12-14-23)7-6-8-18(15-27-17(2)24)9-10-19(25)22(5)13-11-20(28-22)21(3,4)26/h8,12,19-20,23,25-26H,6-7,9-11,13-15H2,1-5H3/b16-12-,18-8-/t19-,20-,22+/m0/s1 |
| Standard InChI (Main Layer) | InChI=1S/C22H38O6/c1-16(12-14-23)7-6-8-18(15-27-17(2)24)9-10-19(25)22(5)13-11-20(28-22)21(3,4)26/h8,12,19-20,23,25-26H,6-7,9-11,13-15H2,1-5H3 |
Cluster
| Phytochemical cluster | |
|---|---|
| KCF-S cluster | No. 5677 |
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 |
|---|---|---|---|---|
| Liatris elegans | 102784 | Asteraceae | asterids | Viridiplantae |