ABU
Summary
Name: | GAMMA-AMINO-BUTANOIC ACID |
Synonyms: | GAMMA(AMINO)-BUTYRIC ACID |
Formula: | C4 H9 N O2 |
Formal charge: | 0 |
Formula weight: | 103.12 Da |
Component type: | NON-POLYMER |
Chemical Identifiers
Program | Version | Name |
ACDLabs | 12.01 | 4-aminobutanoic acid |
OpenEye OEToolkits | 1.7.0 | 4-azanylbutanoic acid |
Chemical Descriptors
Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | O=C(O)CCCN |
SMILES_CANONICAL | CACTVS | 3.370 | NCCCC(O)=O |
SMILES | CACTVS | 3.370 | NCCCC(O)=O |
SMILES_CANONICAL | OpenEye OEToolkits | 1.7.0 | C(CC(=O)O)CN |
SMILES | OpenEye OEToolkits | 1.7.0 | C(CC(=O)O)CN |
InChI | InChI | 1.03 | InChI=1S/C4H9NO2/c5-3-1-2-4(6)7/h1-3,5H2,(H,6,7) |
InChIKey | InChI | 1.03 | BTCSSZJGUNDROE-UHFFFAOYSA-N |