KNApSAcK Metabolite C00022648
Metabolite
KNApSAcK Entry
| id | C00022648 |
|---|---|
| Name | Gutierrezianolic acid isobutyrate methyl ester |
| CAS RN | |
| Standard InChI | InChI=1S/C25H38O4/c1-17(2)15-29-21-14-19(23(26)27-6)20(9-8-18-10-13-28-16-18)25(5)12-7-11-24(3,4)22(21)25/h10,13-14,16-17,20-22H,7-9,11-12,15H2,1-6H3/t20-,21-,22-,25+/m0/s1 |
| Standard InChI (Main Layer) | InChI=1S/C25H38O4/c1-17(2)15-29-21-14-19(23(26)27-6)20(9-8-18-10-13-28-16-18)25(5)12-7-11-24(3,4)22(21)25/h10,13-14,16-17,20-22H,7-9,11-12,15H2,1-6H3 |
Cluster
| Phytochemical cluster | |
|---|---|
| KCF-S cluster | No. 829 |
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 |
|---|---|---|---|---|
| Gutierrezia espinosae | 71047 | Asteraceae | asterids | Viridiplantae |