| Name |
Allithiamine |
| Formula |
C15H22N4O2S2 |
| Mw |
354.11841744 |
| CAS RN |
554-44-9 |
| C_ID |
C00054938
|
| InChIKey |
WNCAVNGLACHSRZ-SDNWHVSQSA-N |
| InChICode |
InChI=1S/C15H22N4O2S2/c1-4-7-22-23-14(5-6-20)11(2)19(10-21)9-13-8-17-12(3)18-15(13)16/h4,8,10,20H,1,5-7,9H2,2-3H3,(H2,16,17,18)/b14-11+ |
| SMILES |
C=CCSS/C(CCO)=C(C)N(C=O)Cc1cnc(C)nc1N |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Alliaceae | Allium sativum  | Ref. |
|
|
zoom in
| Organism | Allium sativum |
|---|
| Reference | Matsukawa, T. et al., Science (Washington, D.C.), 1953, 118, 325 (isol, struct) |
|---|
|
