EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C21H32N6O3 |
| Net Charge | 0 |
| Average Mass | 416.526 |
| Monoisotopic Mass | 416.25359 |
| SMILES | [H][C@@](C=O)(CCCN=C(N)N)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](Cc1ccccc1)NC |
| InChI | InChI=1S/C21H32N6O3/c1-24-17(13-15-7-3-2-4-8-15)20(30)27-12-6-10-18(27)19(29)26-16(14-28)9-5-11-25-21(22)23/h2-4,7-8,14,16-18,24H,5-6,9-13H2,1H3,(H,26,29)(H4,22,23,25)/t16-,17+,18-/m0/s1 |
| InChIKey | KAGLWQUWUNBAOO-KSZLIROESA-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) |
| efegatran (CHEBI:748857) is a dipeptide (CHEBI:46761) |
| INN | Source |
|---|---|
| efegatran | WHO MedNet |
| Synonyms | Source |
|---|---|
| LY-294468 | ChEMBL |
| LY294468 | ChEMBL |
| Citations |
|---|