KNApSAcK Metabolite C00022402
Metabolite
KNApSAcK Entry
| id | C00022402 |
|---|---|
| Name | 2-Methylbutanoyl gutespinolide |
| CAS RN | 126873-97-0 / 126770-80-7 |
| Standard InChI | InChI=1S/C25H34O5/c1-6-15(2)22(26)30-20-12-17-18(25(5)10-7-9-24(3,4)21(20)25)13-19(29-23(17)27)16-8-11-28-14-16/h8,11-12,14-15,18-21H,6-7,9-10,13H2,1-5H3/t15?,18-,19+,20-,21-,25+/m0/s1 |
| Standard InChI (Main Layer) | InChI=1S/C25H34O5/c1-6-15(2)22(26)30-20-12-17-18(25(5)10-7-9-24(3,4)21(20)25)13-19(29-23(17)27)16-8-11-28-14-16/h8,11-12,14-15,18-21H,6-7,9-10,13H2,1-5H3 |
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 |