LTA
Summary
| Name: | 4,8-DIAMINO-3-HYDROXY-OCTANOIC ACID ETHYL ESTER |
| Synonyms: | STATINE ANALOGUE |
| Formula: | C10 H22 N2 O3 |
| Formal charge: | 0 |
| Formula weight: | 218.293 Da |
| Component type: | L-PEPTIDE LINKING |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | ethyl (3S,4S)-4,8-diamino-3-hydroxyoctanoate |
| OpenEye OEToolkits | 1.5.0 | ethyl (3S,4S)-4,8-diamino-3-hydroxy-octanoate |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | O=C(OCC)CC(O)C(N)CCCCN |
| SMILES_CANONICAL | CACTVS | 3.341 | CCOC(=O)C[C@H](O)[C@@H](N)CCCCN |
| SMILES | CACTVS | 3.341 | CCOC(=O)C[CH](O)[CH](N)CCCCN |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | CCOC(=O)C[C@@H]([C@H](CCCCN)N)O |
| SMILES | OpenEye OEToolkits | 1.5.0 | CCOC(=O)CC(C(CCCCN)N)O |
| InChI | InChI | 1.03 | InChI=1S/C10H22N2O3/c1-2-15-10(14)7-9(13)8(12)5-3-4-6-11/h8-9,13H,2-7,11-12H2,1H3/t8-,9-/m0/s1 |
| InChIKey | InChI | 1.03 | YWYXVAACIALMCZ-IUCAKERBSA-N |
