GWO
Summary
| Name: | (2R,4R,5S)-5-azanyl-4-oxidanyl-6-phenyl-2-(phenylmethyl)hexanoic acid |
| Formula: | C19 H23 N O3 |
| Formal charge: | 0 |
| Formula weight: | 313.391 Da |
| Component type: | peptide-like |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | (2~{R},4~{R},5~{S})-5-azanyl-4-oxidanyl-6-phenyl-2-(phenylmethyl)hexanoic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C19H23NO3/c20-17(12-15-9-5-2-6-10-15)18(21)13-16(19(22)23)11-14-7-3-1-4-8-14/h1-10,16-18,21H,11-13,20H2,(H,22,23)/t16-,17+,18-/m1/s1 |
| InChIKey | InChI | 1.03 | FXTZKZFWIYSHRP-FGTMMUONSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | N[C@@H](Cc1ccccc1)[C@H](O)C[C@@H](Cc2ccccc2)C(O)=O |
| SMILES | CACTVS | 3.385 | N[CH](Cc1ccccc1)[CH](O)C[CH](Cc2ccccc2)C(O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1ccc(cc1)C[C@H](C[C@H]([C@H](Cc2ccccc2)N)O)C(=O)O |
| SMILES | OpenEye OEToolkits | 2.0.7 | c1ccc(cc1)CC(CC(C(Cc2ccccc2)N)O)C(=O)O |
