EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | H2O4S.C24H44N2O4.H2O4S |
| Net Charge | 0 |
| Average Mass | 620.784 |
| Monoisotopic Mass | 620.26487 |
| SMILES | CN1C(C)(C)CC(OC(=O)CCC(=O)OC2CC(C)(C)N(C)C(C)(C)C2)CC1(C)C.O=S(=O)(O)O.O=S(=O)(O)O |
| InChI | InChI=1S/C24H44N2O4.2H2O4S/c1-21(2)13-17(14-22(3,4)25(21)9)29-19(27)11-12-20(28)30-18-15-23(5,6)26(10)24(7,8)16-18;2*1-5(2,3)4/h17-18H,11-16H2,1-10H3;2*(H2,1,2,3,4) |
| InChIKey | VGVAGSHQBXDIOJ-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| suxemerid sulfate (CHEBI:756239) is a fatty acid ester (CHEBI:35748) |
| Synonyms | Source |
|---|---|
| Suxemerid sulfate | ChEMBL |
| Suxemerid sulphate | ChEMBL |
| W 2180 | ChEMBL |
| W-2180 | ChEMBL |