| PDB CCD ID: | X9Q |
| Number of entries in BioLiP: | 0 |
| Chemical formula: | C14 H17 N3 O3 |
| InChI: | InChI=1S/C14H17N3O3/c1-9(15)13-16-11(7-10-5-3-2-4-6-10)14(20)17(13)8-12(18)19/h2-6,9,13H,7-8,15H2,1H3,(H,18,19)/t9-,13-/m0/s1 |
| InChIKey: | IGZCWBWPHPOBFS-ZANVPECISA-N |
| SMILES: | | Software | SMILES |
|---|
| OpenEye OEToolkits 1.5.0 | CC(C1N=C(C(=O)N1CC(=O)O)Cc2ccccc2)N | | OpenEye OEToolkits 1.5.0 | C[C@@H](C1N=C(C(=O)N1CC(=O)O)Cc2ccccc2)N | | CACTVS 3.341 | C[C@H](N)[C@H]1N=C(Cc2ccccc2)C(=O)N1CC(O)=O | | CACTVS 3.341 | C[CH](N)[CH]1N=C(Cc2ccccc2)C(=O)N1CC(O)=O | | ACDLabs 10.04 | O=C1C(=NC(N1CC(=O)O)C(N)C)Cc2ccccc2 |
|
| Name: | {(2S)-2-[(1S)-1-AMINOETHYL]-4-BENZYL-5-OXO-2,5-DIHYDRO-1H-IMIDAZOL-1-YL}ACETIC ACID;
CHROMOPHORE (ALA, PHE, GLY) |
| ZINC: | ZINC000103560997 |
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