2-[(2-Amino-3-methylbutanoyl)amino]propanoic acid
Basic information
- CAS
1115-74-8- Standard SMILES
CC(NC(=O)C(N)C(C)C)C(=O)O- InChIKey
HSRXSKHRSXRCFC-UHFFFAOYSA-N- Molecular formula
- C8H16N2O3
- Average molar mass
- 188.22 g/mol
- Monoisotopic mass
- 188.11609237
Overview
See also: Val-Ala (annotation moved to).
Names & identifiers
- Preferred name
- 2-[(2-Amino-3-methylbutanoyl)amino]propanoic acid
- IUPAC
- 2-[(2-amino-3-methylbutanoyl)amino]propanoic acid
Names & synonyms
2-[(2-amino-3-methylbutanoyl)amino]propanoic acidVal-Ala-OHNSC339920SCHEMBL1711404AKOS010405329NSC-3399202-[(2-amino-3-methyl-butanoyl)amino]propanoic acid
Database identifiers
- CAS
1115-74-8- PubChem CID
- 334517
- DTXSID
DTXSID50319114
Properties
Computed structural properties
- XLogP
- -3.8
- Topological polar surface area
- 92.4 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 204
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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