EMBL-EBI | Chemical Biology | ChEBI
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| Formula | HCl.C27H41N5O4 |
| Net Charge | 0 |
| Average Mass | 536.117 |
| Monoisotopic Mass | 535.29253 |
| SMILES | COCCCCn1c(C(=O)N(CC(C)C)[C@@H]2CNC[C@H](C(=O)N3CCOCC3)C2)nc2ccccc21.Cl |
| InChI | InChI=1S/C27H41N5O4.ClH/c1-20(2)19-32(22-16-21(17-28-18-22)26(33)30-11-14-36-15-12-30)27(34)25-29-23-8-4-5-9-24(23)31(25)10-6-7-13-35-3;/h4-5,8-9,20-22,28H,6-7,10-19H2,1-3H3;1H/t21-,22+;/m1./s1 |
| InChIKey | PUXOYQIZZIWCHH-NSLUPJTDSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| imarikiren hydrochloride (CHEBI:756016) has functional parent β-amino acid (CHEBI:33706) |
| imarikiren hydrochloride (CHEBI:756016) is a organonitrogen compound (CHEBI:35352) |
| imarikiren hydrochloride (CHEBI:756016) is a organooxygen compound (CHEBI:36963) |
| Synonyms | Source |
|---|---|
| Imarikiren hydrochloride | ChEMBL |
| TAK-272 | ChEMBL |
| TAK-272, (+)- | ChEMBL |
| Citations |
|---|