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CHEBI:191111 - Famotidine acid methyl ester
| Formula | C9H14N4O2S2 |
| Net Charge | 0 |
| Average Mass | 274.371 |
| Monoisotopic Mass | 274.05582 |
| SMILES | COC(=O)CCSCc1csc(N=C(N)N)n1 |
| InChI | InChI=1S/C9H14N4O2S2/c1-15-7(14)2-3-16-4-6-5-17-9(12-6)13-8(10)11/h5H,2-4H2,1H3,(H4,10,11,12,13) |
| InChIKey | LNBNICMKLBBRMB-UHFFFAOYSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Rattus norvegicus (ncbitaxon:10116) | INS-1 cell (BTO:0002135) | MetaboLights (MTBLS3963) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Famotidine acid methyl ester (CHEBI:191111) is a thiazoles (CHEBI:48901) |
| IUPAC Name |
|---|
| methyl 3-[[2-(diaminomethylideneamino)-1,3-thiazol-4-yl]methylsulanyl]propanoate |
| Manual Xrefs | Databases |
|---|---|
| 14802732 | ChemSpider |
| Registry Numbers | Sources |
|---|---|
| CAS:76824-14-1 | ChemIDplus |