EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C15H29N3O4S |
| Net Charge | 0 |
| Average Mass | 347.481 |
| Monoisotopic Mass | 347.18788 |
| SMILES | CC[C@H](C)[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)CS)C(=O)O |
| InChI | InChI=1S/C15H29N3O4S/c1-5-9(4)12(15(21)22)18-14(20)11(6-8(2)3)17-13(19)10(16)7-23/h8-12,23H,5-7,16H2,1-4H3,(H,17,19)(H,18,20)(H,21,22)/t9-,10-,11-,12-/m0/s1 |
| InChIKey | VPQZSNQICFCCSO-BJDJZHNGSA-N |
| Roles Classification |
|---|
| Chemical Role: | Bronsted base A molecular entity capable of accepting a hydron from a donor (Brønsted acid). |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Cys-Leu-Ile (CHEBI:161480) is a tripeptide (CHEBI:47923) |
| IUPAC Name |
|---|
| (2S,3S)-2-[[(2S)-2-[[(2R)-2-amino-3-sulanylpropanoyl]amino]-4-methylpentanoyl]amino]-3-methylpentanoic acid |