EMBL-EBI | Chemical Biology | ChEBI
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| Formula | H2O.C17H18N3O3S.C17H18N3O3S.Sr.H2O.H2O.H2O |
| Net Charge | 0 |
| Average Mass | 848.512 |
| Monoisotopic Mass | 848.16165 |
| SMILES | COc1ccc2[n-]c([S@@+]([O-])Cc3ncc(C)c(OC)c3C)nc2c1.COc1ccc2[n-]c([S@@+]([O-])Cc3ncc(C)c(OC)c3C)nc2c1.O.O.O.O.[Sr+2] |
| InChI | InChI=1S/2C17H18N3O3S.4H2O.Sr/c2*1-10-8-18-15(11(2)16(10)23-4)9-24(21)17-19-13-6-5-12(22-3)7-14(13)20-17;;;;;/h2*5-8H,9H2,1-4H3;4*1H2;/q2*-1;;;;;+2/t2*24-;;;;;/m00...../s1 |
| InChIKey | NCGHIAKEJNQSMS-QLGOZJDFSA-N |
| Roles Classification |
|---|
| Application: | anti-ulcer drug One of various classes of drugs with different action mechanisms used to treat or ameliorate peptic ulcer or irritation of the gastrointestinal tract. |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| esomeprazole strontium (CHEBI:754803) has role anti-ulcer drug (CHEBI:49201) |
| esomeprazole strontium (CHEBI:754803) is a benzimidazoles (CHEBI:22715) |
| esomeprazole strontium (CHEBI:754803) is a sulfoxide (CHEBI:22063) |
| Synonyms | Source |
|---|---|
| FM-0F67 | ChEMBL |
| FM0F67 | ChEMBL |
| Hip1601 | ChEMBL |
| HIP-1601 | ChEMBL |
| S-omeprazole strontium hydrate | ChEMBL |