3-[(2-Amino-4-methylpentanoyl)amino]propanoic acid
Basic information
- CAS
30806-09-8- Standard SMILES
CC(C)CC(N)C(=O)NCCC(=O)O- InChIKey
CFXOQFNBROAEHM-UHFFFAOYSA-N- Molecular formula
- C9H18N2O3
- Average molar mass
- 202.25 g/mol
- Monoisotopic mass
- 202.13174244
Names & identifiers
- Preferred name
- 3-[(2-Amino-4-methylpentanoyl)amino]propanoic acid
- IUPAC
- 3-[(2-amino-4-methylpentanoyl)amino]propanoic acid
- English name
- H-Leu-beta-Ala-OH
- Molecular formula
- C9H18N2O3
- Molecular weight
- 202.25
Names & synonyms
3-((2S)-2-amino-4-methylpentanoylamino)propanoic acid3-(2-amino-4-methylpentanamido)propanoic acidH-Leu-beta-Ala-OH3-[(2-amino-4-methylpentanoyl)amino]propanoic acidNSC343020AKOS010404013NSC-343020ST104657ST50410917H-Leu-β-Ala-OHleu-B-alaH-LEU-BALA-OH
Show more names
L-LEUCYL-B-ALANINEL-Leucyl-!-alanineβ-Alanine, L-leucyl-L-LEUCYL-BETA-ALANINE
Database identifiers
- CAS
30806-09-8- PubChem CID
- 335046
Properties
Computed structural properties
- XLogP
- -2.4
- Topological polar surface area
- 92.4 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 204
Physicochemical properties
- storage temp.
- 20 °C · −20°C
Chemistry & industry
Additional notes
DefinitionChEBI: Leu-beta-Ala is a dipeptide formed from L-leucine and beta-alanine residues.
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…