KNApSAcK Metabolite C00007593
Metabolite
KNApSAcK Entry
| id | C00007593 |
|---|---|
| Name | Glucoberteroin / 5-Methylthiopentylglucosinolate |
| CAS RN | 29611-01-6 |
| Standard InChI | InChI=1S/C13H25NO9S3/c1-24-6-4-2-3-5-9(14-23-26(19,20)21)25-13-12(18)11(17)10(16)8(7-15)22-13/h8,10-13,15-18H,2-7H2,1H3,(H,19,20,21)/b14-9-/t8?,10-,11+,12?,13+/m0/s1 |
| Standard InChI (Main Layer) | InChI=1S/C13H25NO9S3/c1-24-6-4-2-3-5-9(14-23-26(19,20)21)25-13-12(18)11(17)10(16)8(7-15)22-13/h8,10-13,15-18H,2-7H2,1H3,(H,19,20,21) |
Cluster
| Phytochemical cluster | No. 76 |
|---|---|
| KCF-S cluster | No. 46 |
Link
ChEMBL
| By standard InChI | |
|---|---|
| By standard InChI Main Layer |
KEGG
| By LinkDB | C08401 |
|---|
CTD
| By CAS RN |
|---|
Species
Summary
Plant class
| class name | count |
|---|---|
| rosids | 42 |
Family
| family name | count |
|---|---|
| Brassicaceae | 42 |