EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C23H31N3O6S |
| Net Charge | 0 |
| Average Mass | 477.583 |
| Monoisotopic Mass | 477.19336 |
| SMILES | [H]O[C@]([H])(C([H])([H])N(C([H])([H])C1([H])C([H])([H])C1([H])[H])S(=O)(=O)c1oc([H])c([H])c1[H])[C@@]([H])(N([H])C(=O)C([H])([H])C([H])([H])C(=O)N([H])C([H])([H])[H])C([H])([H])c1c([H])c([H])c([H])c([H])c1[H] |
| InChI | InChI=1S/C23H31N3O6S/c1-24-21(28)11-12-22(29)25-19(14-17-6-3-2-4-7-17)20(27)16-26(15-18-9-10-18)33(30,31)23-8-5-13-32-23/h2-8,13,18-20,27H,9-12,14-16H2,1H3,(H,24,28)(H,25,29)/t19-,20+/m0/s1 |
| InChIKey | IKOPFHKAECNGQI-VQTJNVASSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| N-{(1S,2R)-1-BENZYL-3-[(CYCLOPROPYLMETHYL)(2-FURYLSULFONYL)AMINO]-2-HYDROXYPROPYL}-N'-METHYLSUCCINAMIDE (CHEBI:44196) is a unclassifieds (CHEBI:27189) |
| Synonyms | Source |
|---|---|
| N-{(1S,2R)-1-BENZYL-3-[(CYCLOPROPYLMETHYL)(2-FURYLSULFONYL)AMINO]-2-HYDROXYPROPYL}-N'-METHYLSUCCINAMIDE | PDBeChem |
| N-{(1S,2R)-1-benzyl-3-[(cyclopropylmethyl)(furan-2-ylsulfonyl)amino]-2-hydroxypropyl}-N'-methylbutanediamide | PDBeChem |
| Manual Xrefs | Databases |
|---|---|
| MUV | PDBeChem |