UNK
Summary
Name: | UNKNOWN |
Formula: | C4 H9 N O2 |
Formal charge: | 0 |
Formula weight: | 103.12 Da |
Component type: | L-PEPTIDE LINKING |
Chemical Identifiers
Program | Version | Name |
ACDLabs | 10.04 | (2S)-2-aminobutanoic acid |
OpenEye OEToolkits | 1.5.0 | (2S)-2-aminobutanoic acid |
Chemical Descriptors
Type | Program | Version | Descriptor |
SMILES | ACDLabs | 10.04 | O=C(O)C(N)CC |
SMILES_CANONICAL | CACTVS | 3.341 | CC[C@H](N)C(O)=O |
SMILES | CACTVS | 3.341 | CC[CH](N)C(O)=O |
SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | CC[C@@H](C(=O)O)N |
SMILES | OpenEye OEToolkits | 1.5.0 | CCC(C(=O)O)N |
InChI | InChI | 1.03 | InChI=1S/C4H9NO2/c1-2-3(5)4(6)7/h3H,2,5H2,1H3,(H,6,7)/t3-/m0/s1 |
InChIKey | InChI | 1.03 | QWCKQJZIFLGMSD-VKHMYHEASA-N |