KNApSAcK Metabolite C00025192
Metabolite
KNApSAcK Entry
| id | C00025192 |
|---|---|
| Name | Nb-Demethylechitamine / N(4)-Demethylechitamine |
| CAS RN | 60048-88-6 |
| Standard InChI | InChI=1S/C21H26N2O4/c1-3-13-11-23-9-8-20-14-6-4-5-7-16(14)22-21(20,23)17(25)10-15(13)19(20,12-24)18(26)27-2/h3-7,15,17,22,24-25H,8-12H2,1-2H3/b13-3+/t15-,17-,19?,20-,21-/m0/s1 |
| Standard InChI (Main Layer) | InChI=1S/C21H26N2O4/c1-3-13-11-23-9-8-20-14-6-4-5-7-16(14)22-21(20,23)17(25)10-15(13)19(20,12-24)18(26)27-2/h3-7,15,17,22,24-25H,8-12H2,1-2H3 |
Cluster
| Phytochemical cluster | |
|---|---|
| KCF-S cluster | No. 3070 |
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 |
|---|---|
| Apocynaceae | 2 |
List (2)
* NCBI
| KNApSAcK organism | *ID | *family | *plant class | *kingdom |
|---|---|---|---|---|
| Alstonia scholaris R.Br. | 52821 | Apocynaceae | asterids | Viridiplantae |
| Winchia calophylla | 4056 | Apocynaceae | asterids | Viridiplantae |