EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C28H39N5O4 |
| Net Charge | 0 |
| Average Mass | 509.651 |
| Monoisotopic Mass | 509.30020 |
| SMILES | CC(C)C(NC(=O)C(N)Cc1ccccc1)C(=O)NC(C(=O)NC(Cc1ccccc1)C(N)=O)C(C)C |
| InChI | InChI=1S/C28H39N5O4/c1-17(2)23(27(36)31-22(25(30)34)16-20-13-9-6-10-14-20)33-28(37)24(18(3)4)32-26(35)21(29)15-19-11-7-5-8-12-19/h5-14,17-18,21-24H,15-16,29H2,1-4H3,(H2,30,34)(H,31,36)(H,32,35)(H,33,37) |
| InChIKey | HOANKSJQDQJAGG-UHFFFAOYSA-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) |
| Bilaid A1 (CHEBI:201386) is a peptide (CHEBI:16670) |
| IUPAC Name |
|---|
| (2R)-N-[(2S)-1-[[(2R)-1-amino-1-oxo-3-phenylpropan-2-yl]amino]-3-methyl-1-oxobutan-2-yl]-2-[[(2S)-2-amino-3-phenylpropanoyl]amino]-3-methylbutanamide |
| Manual Xrefs | Databases |
|---|---|
| 90606586 | ChemSpider |