EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
CHEBI:201412 - Sulopenem
| Formula | C12H15NO5S3 |
| Net Charge | 0 |
| Average Mass | 349.455 |
| Monoisotopic Mass | 349.01124 |
| SMILES | CC(O)C1C(=O)N2C(C(=O)O)=C(SC3CCS(=O)C3)SC12 |
| InChI | InChI=1S/C12H15NO5S3/c1-5(14)7-9(15)13-8(11(16)17)12(20-10(7)13)19-6-2-3-21(18)4-6/h5-7,10,14H,2-4H2,1H3,(H,16,17) |
| InChIKey | FLSUCZWOEMTFAQ-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Sulopenem (CHEBI:201412) has functional parent α-amino acid (CHEBI:33704) |
| Sulopenem (CHEBI:201412) is a organonitrogen compound (CHEBI:35352) |
| Sulopenem (CHEBI:201412) is a organooxygen compound (CHEBI:36963) |
| IUPAC Name |
|---|
| (5R,6S)-6-[(1R)-1-hydroxyethyl]-7-oxo-3-[(1R,3S)-1-oxothiolan-3-yl]sulanyl-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid |