KNApSAcK Metabolite C00022636
Metabolite
KNApSAcK Entry
| id | C00022636 |
|---|---|
| Name | 17-[2-Methylbutyryloxy]-grindelic acid |
| CAS RN | 81916-51-0 |
| Standard InChI | InChI=1S/C25H40O5/c1-7-17(2)21(28)29-16-18-9-10-19-22(3,4)11-8-12-24(19,6)25(18)14-13-23(5,30-25)15-20(26)27/h9,17,19H,7-8,10-16H2,1-6H3,(H,26,27)/t17?,19-,23-,24-,25+/m0/s1 |
| Standard InChI (Main Layer) | InChI=1S/C25H40O5/c1-7-17(2)21(28)29-16-18-9-10-19-22(3,4)11-8-12-24(19,6)25(18)14-13-23(5,30-25)15-20(26)27/h9,17,19H,7-8,10-16H2,1-6H3,(H,26,27) |
Cluster
| Phytochemical cluster | No. 38 |
|---|---|
| KCF-S cluster | No. 252 |
Link
ChEMBL
| By standard InChI | |
|---|---|
| By standard InChI Main Layer |
KEGG
| By LinkDB |
|---|
CTD
| By CAS RN |
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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 |
|---|---|---|---|---|
| Grindelia stricta | 1114762 | Asteraceae | asterids | Viridiplantae |