KNApSAcK Metabolite C00022734
Metabolite
KNApSAcK Entry
| id | C00022734 |
|---|---|
| Name | (ent-2alpha,3beta,13Z)-3-Angeloyloxy-8(17),13-labdadiene-2,15,16,18-tetrol |
| CAS RN | 99624-41-6 |
| Standard InChI | InChI=1S/C25H40O6/c1-6-16(2)23(30)31-22-20(29)13-24(4)19(9-8-18(14-27)11-12-26)17(3)7-10-21(24)25(22,5)15-28/h6,11,19-22,26-29H,3,7-10,12-15H2,1-2,4-5H3/b16-6-,18-11-/t19-,20+,21?,22-,24+,25-/m1/s1 |
| Standard InChI (Main Layer) | InChI=1S/C25H40O6/c1-6-16(2)23(30)31-22-20(29)13-24(4)19(9-8-18(14-27)11-12-26)17(3)7-10-21(24)25(22,5)15-28/h6,11,19-22,26-29H,3,7-10,12-15H2,1-2,4-5H3 |
Cluster
| Phytochemical cluster | |
|---|---|
| KCF-S cluster | No. 1548 |
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 solbrigii | 71047 | Asteraceae | asterids | Viridiplantae |