KNApSAcK Metabolite C00010691
Metabolite
KNApSAcK Entry
| id | C00010691 |
|---|---|
| Name | Acetylbarlerin |
| CAS RN | 57420-45-8 |
| Standard InChI | InChI=1S/C21H30O13/c1-8(23)31-11-5-21(3,34-9(2)24)14-13(11)10(18(28)29-4)7-30-19(14)33-20-17(27)16(26)15(25)12(6-22)32-20/h7,11-17,19-20,22,25-27H,5-6H2,1-4H3/t11-,12?,13+,14-,15-,16?,17+,19+,20-,21+/m1/s1 |
| Standard InChI (Main Layer) | InChI=1S/C21H30O13/c1-8(23)31-11-5-21(3,34-9(2)24)14-13(11)10(18(28)29-4)7-30-19(14)33-20-17(27)16(26)15(25)12(6-22)32-20/h7,11-17,19-20,22,25-27H,5-6H2,1-4H3 |
Cluster
| Phytochemical cluster | No. 36 |
|---|---|
| KCF-S cluster | No. 56 |
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 | 2 |
Family
| family name | count |
|---|---|
| Acanthaceae | 2 |
List (2)
* NCBI
| KNApSAcK organism | *ID | *family | *plant class | *kingdom |
|---|---|---|---|---|
| Barleria lupulina | 101743 | Acanthaceae | asterids | Viridiplantae |
| Barleria prionitis | 4189 | Acanthaceae | asterids | Viridiplantae |