KNApSAcK Metabolite C00025915
Metabolite
KNApSAcK Entry
| id | C00025915 |
|---|---|
| Name | Isovallesiachotamine / (Z)-Vallesiachotamine / 17-Isovallesiachotamine |
| CAS RN | 34384-71-9 |
| Standard InChI | InChI=1S/C21H22N2O3/c1-3-13(12-24)16-10-19-20-15(14-6-4-5-7-18(14)22-20)8-9-23(19)11-17(16)21(25)26-2/h3-7,11-12,16,19,22H,8-10H2,1-2H3/b13-3+/t16-,19-/m0/s1 |
| Standard InChI (Main Layer) | InChI=1S/C21H22N2O3/c1-3-13(12-24)16-10-19-20-15(14-6-4-5-7-18(14)22-20)8-9-23(19)11-17(16)21(25)26-2/h3-7,11-12,16,19,22H,8-10H2,1-2H3 |
Cluster
| Phytochemical cluster | |
|---|---|
| KCF-S cluster | No. 4951 |
Link
ChEMBL
| By standard InChI | CHEMBL449796 |
|---|---|
| By standard InChI Main Layer | CHEMBL454571 CHEMBL449796 |
KEGG
| By LinkDB |
|---|
CTD
| By CAS RN |
|---|
Species
Summary
Plant class
| class name | count |
|---|---|
| asterids | 3 |
Family
| family name | count |
|---|---|
| Rubiaceae | 2 |
| Apocynaceae | 1 |
List (3)
* NCBI
| KNApSAcK organism | *ID | *family | *plant class | *kingdom |
|---|---|---|---|---|
| Chimarrhis turbinata | 128292 | Rubiaceae | asterids | Viridiplantae |
| Psychotria bahiensis | 96277 | Rubiaceae | asterids | Viridiplantae |
| Tabernaemontana psorocarpa (Pierre ex Stapf) Pichon | 761091 | Apocynaceae | asterids | Viridiplantae |