KNApSAcK Metabolite C00007837
Metabolite
KNApSAcK Entry
| id | C00007837 |
|---|---|
| Name | 6-(Methylsulfonyl)hexyl glucosinolate |
| CAS RN | 74542-18-0 |
| Standard InChI | InChI=1S/C14H27NO11S3/c1-28(20,21)7-5-3-2-4-6-10(15-26-29(22,23)24)27-14-13(19)12(18)11(17)9(8-16)25-14/h9,11-14,16-19H,2-8H2,1H3,(H,22,23,24)/b15-10-/t9?,11-,12?,13+,14+/m0/s1 |
| Standard InChI (Main Layer) | InChI=1S/C14H27NO11S3/c1-28(20,21)7-5-3-2-4-6-10(15-26-29(22,23)24)27-14-13(19)12(18)11(17)9(8-16)25-14/h9,11-14,16-19H,2-8H2,1H3,(H,22,23,24) |
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 | 2 |
Family
| family name | count |
|---|---|
| Brassicaceae | 2 |
List (2)
* NCBI
| KNApSAcK organism | *ID | *family | *plant class | *kingdom |
|---|---|---|---|---|
| Boechera drummondii | 72658 | Brassicaceae | rosids | Viridiplantae |
| Erysimum rhaeticum | 761866 | Brassicaceae | rosids | Viridiplantae |