KNApSAcK Metabolite C00025755
Metabolite
KNApSAcK Entry
| id | C00025755 |
|---|---|
| Name | 6-Hydroxy-3-oxoisovoacangine / (-)-6-Hydroxy-3-oxoisovoacangine |
| CAS RN | 53508-35-3 |
| Standard InChI | InChI=1S/C22H26N2O5/c1-4-11-7-12-9-22(21(27)29-3)18-17(16(25)10-24(19(11)22)20(12)26)14-6-5-13(28-2)8-15(14)23-18/h5-6,8,11-12,16,19,23,25H,4,7,9-10H2,1-3H3/t11-,12+,16?,19-,22+/m0/s1 |
| Standard InChI (Main Layer) | InChI=1S/C22H26N2O5/c1-4-11-7-12-9-22(21(27)29-3)18-17(16(25)10-24(19(11)22)20(12)26)14-6-5-13(28-2)8-15(14)23-18/h5-6,8,11-12,16,19,23,25H,4,7,9-10H2,1-3H3 |
Cluster
| Phytochemical cluster | No. 4 |
|---|---|
| KCF-S cluster | No. 250 |
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 |
|---|---|
| Apocynaceae | 1 |
List (1)
* NCBI
| KNApSAcK organism | *ID | *family | *plant class | *kingdom |
|---|---|---|---|---|
| Tabernaemontana sessilifolia Bak. | 52860 | Apocynaceae | asterids | Viridiplantae |