62H
Summary
Name: | (2S)-3-amino-2-methylpropanoic acid |
Formula: | C4 H9 N O2 |
Formal charge: | 0 |
Formula weight: | 103.12 Da |
Component type: | L-peptide linking |
Chemical Identifiers
Program | Version | Name |
ACDLabs | 12.01 | (2S)-3-amino-2-methylpropanoic acid |
OpenEye OEToolkits | 2.0.4 | (2~{S})-3-azanyl-2-methyl-propanoic acid |
Chemical Descriptors
Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | NCC(C(=O)O)C |
InChI | InChI | 1.03 | InChI=1S/C4H9NO2/c1-3(2-5)4(6)7/h3H,2,5H2,1H3,(H,6,7)/t3-/m0/s1 |
InChIKey | InChI | 1.03 | QCHPKSFMDHPSNR-VKHMYHEASA-N |
SMILES_CANONICAL | CACTVS | 3.385 | C[C@@H](CN)C(O)=O |
SMILES | CACTVS | 3.385 | C[CH](CN)C(O)=O |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.4 | C[C@@H](CN)C(=O)O |
SMILES | OpenEye OEToolkits | 2.0.4 | CC(CN)C(=O)O |