1OP
Summary
| Name: | O-(5-hydroxypentyl)-L-tyrosine |
| Formula: | C14 H21 N O4 |
| Formal charge: | 0 |
| Formula weight: | 267.321 Da |
| Component type: | L-PEPTIDE LINKING |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | O-(5-hydroxypentyl)-L-tyrosine |
| OpenEye OEToolkits | 1.7.6 | (2S)-2-azanyl-3-[4-(5-oxidanylpentoxy)phenyl]propanoic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | O=C(O)C(N)Cc1ccc(OCCCCCO)cc1 |
| InChI | InChI | 1.03 | InChI=1S/C14H21NO4/c15-13(14(17)18)10-11-4-6-12(7-5-11)19-9-3-1-2-8-16/h4-7,13,16H,1-3,8-10,15H2,(H,17,18)/t13-/m0/s1 |
| InChIKey | InChI | 1.03 | IAPUVAQPXWAJKV-ZDUSSCGKSA-N |
| SMILES_CANONICAL | CACTVS | 3.370 | N[C@@H](Cc1ccc(OCCCCCO)cc1)C(O)=O |
| SMILES | CACTVS | 3.370 | N[CH](Cc1ccc(OCCCCCO)cc1)C(O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.6 | c1cc(ccc1C[C@@H](C(=O)O)N)OCCCCCO |
| SMILES | OpenEye OEToolkits | 1.7.6 | c1cc(ccc1CC(C(=O)O)N)OCCCCCO |
