5GM
Summary
| Name: | (4S)-2,4-dimethyl-L-norleucine |
| Formula: | C8 H17 N O2 |
| Formal charge: | 0 |
| Formula weight: | 159.226 Da |
| Component type: | L-peptide linking |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | (4S)-2,4-dimethyl-L-norleucine |
| OpenEye OEToolkits | 1.7.6 | (2S,4S)-2-azanyl-2,4-dimethyl-hexanoic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | NC(C(=O)O)(CC(C)CC)C |
| InChI | InChI | 1.03 | InChI=1S/C8H17NO2/c1-4-6(2)5-8(3,9)7(10)11/h6H,4-5,9H2,1-3H3,(H,10,11)/t6-,8-/m0/s1 |
| InChIKey | InChI | 1.03 | YWAJMILGBXVJTJ-XPUUQOCRSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CC[C@H](C)C[C@](C)(N)C(O)=O |
| SMILES | CACTVS | 3.385 | CC[CH](C)C[C](C)(N)C(O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.6 | CC[C@H](C)C[C@@](C)(C(=O)O)N |
| SMILES | OpenEye OEToolkits | 1.7.6 | CCC(C)CC(C)(C(=O)O)N |
