KNApSAcK Metabolite C00007844
Metabolite
KNApSAcK Entry
| id | C00007844 |
|---|---|
| Name | Glucolesquerellin / 6-(Methylthio)hexyl glucosinolate |
| CAS RN | 74542-17-9 |
| Standard InChI | InChI=1S/C14H27NO9S3/c1-25-7-5-3-2-4-6-10(15-24-27(20,21)22)26-14-13(19)12(18)11(17)9(8-16)23-14/h9,11-14,16-19H,2-8H2,1H3,(H,20,21,22)/b15-10-/t9?,11-,12?,13+,14+/m0/s1 |
| Standard InChI (Main Layer) | InChI=1S/C14H27NO9S3/c1-25-7-5-3-2-4-6-10(15-24-27(20,21)22)26-14-13(19)12(18)11(17)9(8-16)23-14/h9,11-14,16-19H,2-8H2,1H3,(H,20,21,22) |
Cluster
| Phytochemical cluster | No. 76 |
|---|---|
| KCF-S cluster | No. 46 |
Link
ChEMBL
| By standard InChI | |
|---|---|
| By standard InChI Main Layer |
KEGG
| By LinkDB |
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CTD
| By CAS RN |
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Species
Summary
Plant class
| class name | count |
|---|---|
| rosids | 29 |
Family
| family name | count |
|---|---|
| Brassicaceae | 29 |