H7V
Summary
| Name: | 3-cyclohexyl-N-methyl-L-alanine |
| Formula: | C10 H19 N O2 |
| Formal charge: | 0 |
| Formula weight: | 185.263 Da |
| Component type: | L-PEPTIDE LINKING |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 3-cyclohexyl-N-methyl-L-alanine |
| OpenEye OEToolkits | 2.0.6 | (2~{S})-3-cyclohexyl-2-(methylamino)propanoic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | N(C(C(O)=O)CC1CCCCC1)C |
| InChI | InChI | 1.03 | InChI=1S/C10H19NO2/c1-11-9(10(12)13)7-8-5-3-2-4-6-8/h8-9,11H,2-7H2,1H3,(H,12,13)/t9-/m0/s1 |
| InChIKey | InChI | 1.03 | GBMDYACPQYNUGA-VIFPVBQESA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CN[C@@H](CC1CCCCC1)C(O)=O |
| SMILES | CACTVS | 3.385 | CN[CH](CC1CCCCC1)C(O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | CN[C@@H](CC1CCCCC1)C(=O)O |
| SMILES | OpenEye OEToolkits | 2.0.6 | CNC(CC1CCCCC1)C(=O)O |
