KNApSAcK Metabolite C00007586
Metabolite
KNApSAcK Entry
| id | C00007586 |
|---|---|
| Name | Gluconapin / 3-Butyl glucosinolate |
| CAS RN | 19041-09-9 |
| Standard InChI | InChI=1S/C11H19NO9S2/c1-2-3-4-7(12-21-23(17,18)19)22-11-10(16)9(15)8(14)6(5-13)20-11/h2,6,8-11,13-16H,1,3-5H2,(H,17,18,19)/b12-7-/t6?,8-,9+,10?,11+/m0/s1 |
| Standard InChI (Main Layer) | InChI=1S/C11H19NO9S2/c1-2-3-4-7(12-21-23(17,18)19)22-11-10(16)9(15)8(14)6(5-13)20-11/h2,6,8-11,13-16H,1,3-5H2,(H,17,18,19) |
Cluster
| Phytochemical cluster | No. 76 |
|---|---|
| KCF-S cluster | No. 46 |
Link
ChEMBL
| By standard InChI | |
|---|---|
| By standard InChI Main Layer |
KEGG
| By LinkDB | C08415 |
|---|
CTD
| By CAS RN |
|---|
Species
Summary
Plant class
| class name | count |
|---|---|
| rosids | 99 |
Family
| family name | count |
|---|---|
| Brassicaceae | 97 |
| Capparaceae | 2 |