KNApSAcK Metabolite C00007811
Metabolite
KNApSAcK Entry
| id | C00007811 |
|---|---|
| Name | 3-Hydroxy-6-(methylsufonyl)hexyl glucosinolate |
| CAS RN | |
| Standard InChI | InChI=1S/C14H27NO12S3/c1-29(21,22)6-2-3-8(17)4-5-10(15-27-30(23,24)25)28-14-13(20)12(19)11(18)9(7-16)26-14/h8-9,11-14,16-20H,2-7H2,1H3,(H,23,24,25)/b15-10-/t8?,9?,11-,12?,13+,14+/m0/s1 |
| Standard InChI (Main Layer) | InChI=1S/C14H27NO12S3/c1-29(21,22)6-2-3-8(17)4-5-10(15-27-30(23,24)25)28-14-13(20)12(19)11(18)9(7-16)26-14/h8-9,11-14,16-20H,2-7H2,1H3,(H,23,24,25) |
Cluster
| Phytochemical cluster | No. 76 |
|---|---|
| KCF-S cluster | No. 46 |
Link
ChEMBL
| By standard InChI | |
|---|---|
| By standard InChI Main Layer |
KEGG
| By LinkDB |
|---|
CTD
| By CAS RN |
|---|
Species
Summary
Plant class
| class name | count |
|---|---|
| rosids | 1 |
Family
| family name | count |
|---|---|
| Brassicaceae | 1 |
List (1)
* NCBI
| KNApSAcK organism | *ID | *family | *plant class | *kingdom |
|---|---|---|---|---|
| Erysimum rhaeticum | 761866 | Brassicaceae | rosids | Viridiplantae |