KNApSAcK Metabolite C00001654
Metabolite
KNApSAcK Entry
| id | C00001654 |
|---|---|
| Name | Mesaconitine |
| CAS RN | 2752-64-9 |
| Standard InChI | InChI=1S/C33H45NO10/c1-17(35)44-33-21-19(14-31(38,28(42-6)26(33)36)27(21)43-29(37)18-10-8-7-9-11-18)32-20(40-4)12-13-30(16-39-3)15-34(2)25(32)22(33)23(41-5)24(30)32/h7-11,19-28,36,38H,12-16H2,1-6H3/t19-,20+,21-,22+,23+,24-,25?,26+,27-,28+,30?,31-,32+,33-/m1/s1 |
| Standard InChI (Main Layer) | InChI=1S/C33H45NO10/c1-17(35)44-33-21-19(14-31(38,28(42-6)26(33)36)27(21)43-29(37)18-10-8-7-9-11-18)32-20(40-4)12-13-30(16-39-3)15-34(2)25(32)22(33)23(41-5)24(30)32/h7-11,19-28,36,38H,12-16H2,1-6H3 |
Cluster
| Phytochemical cluster | No. 10 |
|---|---|
| KCF-S cluster | No. 138 |
Link
ChEMBL
| By standard InChI | |
|---|---|
| By standard InChI Main Layer | CHEMBL400315 CHEMBL2062951 |
KEGG
| By LinkDB | C08698 |
|---|
CTD
| By CAS RN | C019470 |
|---|
Species
Summary
Plant class
| class name | count |
|---|---|
| eudicotyledons | 1 |
Family
| family name | count |
|---|---|
| Ranunculaceae | 1 |
List (1)
* NCBI
| KNApSAcK organism | *ID | *family | *plant class | *kingdom |
|---|---|---|---|---|
| Aconitum napellus | 112591 | Ranunculaceae | eudicotyledons | Viridiplantae |