PRD_000252
Ac-Tyr-Val-Ala-Asp-Aldehyde
PRD_000252 is described in the Biologically Interesting Molecule Reference Dictionary (BIRD).
The representative PDB ID is 1ICE.
Chemical Component Summary | |
|---|---|
| Name | Ac-Tyr-Val-Ala-Asp-Aldehyde |
| Identifiers | (3S)-3-[[(2S)-2-[[(2S)-2-[[(2S)-2-acetamido-3-(4-hydroxyphenyl)propanoyl]amino]-3-methyl-butanoyl]amino]propanoyl]amino]-4-oxidanylidene-butanoic acid |
| Formula | C23 H32 N4 O8 |
| Molecular Weight | 492.522 |
| Type | PEPTIDE-LIKE |
| Isomeric SMILES | C[C@@H](C(=O)N[C@@H](CC(=O)O)C=O)NC(=O)[C@H](C(C)C)NC(=O)[C@H](Cc1ccc(cc1)O)NC(=O)C |
| InChI | InChI=1S/C23H32N4O8/c1-12(2)20(23(35)24-13(3)21(33)26-16(11-28)10-19(31)32)27-22(34)18(25-14(4)29)9-15-5-7-17(30)8-6-15/h5-8,11-13,16,18,20,30H,9-10H2,1-4H3,(H,24,35)(H,25,29)(H,26,33)(H,27,34)(H,31,32) |
| InChIKey | LPIARALSGDVZEP-UHFFFAOYSA-N |
| Composition | Polymer Sequences: ACE-TYR-VAL-ALA-ASA |
| BIRD class | INHIBITOR |
| Represented As | POLYMER |
| Compound Details | n/a |
| Description | n/a |
Chemical Details | |
|---|---|
| Formal Charge | 0 |
| Atom Count | 67 |
| Chiral Atom Count | 4 |
| Bond Count | 67 |
| Aromatic Bond Count | 6 |
Related Resource References
| Resource Name | Reference |
|---|---|
| PubChem | 5311139 |
| ChEMBL | CHEMBL37630 |
