| PDB CCD ID: | TYT |
| Number of entries in BioLiP: | 0 |
| Chemical formula: | C18 H20 N2 O4 |
| InChI: | InChI=1S/C18H20N2O4/c19-13(18(23)24)6-11-7-15(17(22)9-16(11)21)20-14-8-12(14)10-4-2-1-3-5-10/h1-5,9,11-14,22H,6-8,19H2,(H,23,24)/b20-15+ |
| InChIKey: | QDTWKLJWNHRCPJ-HMMYKYKNSA-N |
| SMILES: | | Software | SMILES |
|---|
| OpenEye OEToolkits 1.5.0 | c1ccc(cc1)C2CC2/N=C/3\CC(C(=O)C=C3O)C[C@@H](C(=O)O)N | | CACTVS 3.341 | NC(CC1CC(=NC2CC2c3ccccc3)C(=CC1=O)O)C(O)=O | | ACDLabs 10.04 | O=C(O)C(N)CC3C(=O)C=C(O)/C(=N/C2CC2c1ccccc1)C3 | | OpenEye OEToolkits 1.5.0 | c1ccc(cc1)C2CC2N=C3CC(C(=O)C=C3O)CC(C(=O)O)N |
|
| Name: | TYROSINE DERIVATIVE;
2-AMINO-3-[4-HYDROXY-6-OXO-3-(2-PHENYL-CYCLOPROPYLIMINO)-CYCLOHEXA-1,4-DIENYL]-PROPIONIC ACID |
| DrugBank: | DB01657 |
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