EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C16H24N4O5S |
| Net Charge | 0 |
| Average Mass | 384.458 |
| Monoisotopic Mass | 384.14674 |
| SMILES | Cn1cnc(S(=O)(=O)N[C@@H]2C=C[C@@H](CC(=O)NCC3CC3)O[C@H]2CO)c1 |
| InChI | InChI=1S/C16H24N4O5S/c1-20-8-16(18-10-20)26(23,24)19-13-5-4-12(25-14(13)9-21)6-15(22)17-7-11-2-3-11/h4-5,8,10-14,19,21H,2-3,6-7,9H2,1H3,(H,17,22)/t12-,13+,14-/m0/s1 |
| InChIKey | JWTJGHMNSRUWKB-MJBXVCDLSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| N-(cyclopropylmethyl)-2-[(2R,3R,6R)-2-(hydroxymethyl)-3-[(1-methyl-4-imidazolyl)sulfonylamino]-3,6-dihydro-2H-pyran-6-yl]acetamide (CHEBI:118749) is a pyrans (CHEBI:26407) |
| Manual Xrefs | Databases |
|---|---|
| LSM-30198 | LINCS |