| Name |
Yersiniabactin |
| Formula |
C21H27N3O4S3 |
| Mw |
481.11636856 |
| CAS RN |
152166-40-0 |
| C_ID |
C00029246
, 
|
| InChIKey |
JHYVWAMMAMCUIR-GXJONALONA-N |
| InChICode |
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 |
| SMILES |
[C@H]1(CS[C@@H](N1)[C@@H]1N=C(SC1)c1ccccc1O)[C@H](C(C1=N[C@](CS1)(C(=O)O)C)(C)C)O |
| Start Substs in Alk. Biosynthesis (Prediction) |
L-Asp |
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Bacteria | Enterobacteriaceae | Yersinia enterocolitica | Ref. |
|
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