3WX
Summary
Name: | 2-methyl-L-proline |
Formula: | C6 H11 N O2 |
Formal charge: | 0 |
Formula weight: | 129.157 Da |
Component type: | peptide-like |
Chemical Identifiers
Program | Version | Name |
ACDLabs | 12.01 | 2-methyl-L-proline |
OpenEye OEToolkits | 1.9.2 | (2S)-2-methylpyrrolidine-2-carboxylic acid |
Chemical Descriptors
Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | O=C(O)C1(NCCC1)C |
InChI | InChI | 1.03 | InChI=1S/C6H11NO2/c1-6(5(8)9)3-2-4-7-6/h7H,2-4H2,1H3,(H,8,9)/t6-/m0/s1 |
InChIKey | InChI | 1.03 | LWHHAVWYGIBIEU-LURJTMIESA-N |
SMILES_CANONICAL | CACTVS | 3.385 | C[C@]1(CCCN1)C(O)=O |
SMILES | CACTVS | 3.385 | C[C]1(CCCN1)C(O)=O |
SMILES_CANONICAL | OpenEye OEToolkits | 1.9.2 | C[C@]1(CCCN1)C(=O)O |
SMILES | OpenEye OEToolkits | 1.9.2 | CC1(CCCN1)C(=O)O |