KNApSAcK Metabolite C00029246
Metabolite
KNApSAcK Entry
| id | C00029246 |
|---|---|
| Name | Yersiniabactin |
| CAS RN | 152166-40-0 |
| Standard InChI | InChI=1S/C21H27N3O4S3/c1-20(2,18-24-21(3,10-31-18)19(27)28)15(26)12-8-30-17(22-12)13-9-29-16(23-13)11-6-4-5-7-14(11)25/h4-7,12-13,15,17,22,25-26H,8-10H2,1-3H3,(H,27,28)/t12-,13+,15+,17?,21+/m0/s1 |
| Standard InChI (Main Layer) | InChI=1S/C21H27N3O4S3/c1-20(2,18-24-21(3,10-31-18)19(27)28)15(26)12-8-30-17(22-12)13-9-29-16(23-13)11-6-4-5-7-14(11)25/h4-7,12-13,15,17,22,25-26H,8-10H2,1-3H3,(H,27,28) |
Cluster
| Phytochemical cluster | |
|---|---|
| KCF-S cluster | No. 3663 |
Link
ChEMBL
| By standard InChI | CHEMBL1221692 |
|---|---|
| By standard InChI Main Layer | CHEMBL1221692 |
KEGG
| By LinkDB | C12038 |
|---|
CTD
| By CAS RN |
|---|
Species
Summary
Plant class
| class name | count |
|---|
Family
| family name | count |
|---|---|
| Enterobacteriaceae | 1 |
List (1)
* NCBI
| KNApSAcK organism | *ID | *family | *plant class | *kingdom |
|---|---|---|---|---|
| Yersinia enterocolitica | 630 | Enterobacteriaceae | Bacteria |