Basic information
- CAS
124756-83-8- Standard SMILES
C[C@H](NC(=O)C[C@H](N)CC(=O)O)C(=O)O- InChIKey
VBMGKLUUUVOQQN-WHFBIAKZSA-N- Molecular formula
- C8H14N2O5
- Average molar mass
- 218.21 g/mol
- Monoisotopic mass
- 218.09027155
Names & identifiers
- Preferred name
- beta-Aminoglutarylalanine
- IUPAC
- (3S)-3-amino-5-[[(1S)-1-carboxyethyl]amino]-5-oxopentanoic acid
- English name
- beta-aminoglutarylalanine
- Molecular formula
- C8H14N2O5
- Molecular weight
- 218.21
Names & synonyms
beta-Aminoglutarylalanine124756-83-8DTXSID90154480RefChem:119199DTXCID9076971D-beta-Aminoglutaryl-ala(3S)-3-Amino-5-{[(1S)-1-carboxyethyl]amino}-5-oxopentanoic acidPentanoic acid, 3-amino-5-((1-carboxyethyl)amino)-5-oxo-, (S-(R*,R*))-Pentanoic acid, 3-amino-5-[(1-carboxyethyl)amino]-5-oxo-, [S-(R*,R*)]- (9CI)
Database identifiers
- CAS
124756-83-8- PubChem CID
- 5487280
- DTXSID
DTXSID90154480- Nikkaji
- J3.292.705J
Properties
Computed structural properties
- XLogP
- -4.2
- Topological polar surface area
- 130 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 6
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 266
Chemistry & industry
Suppliers1 total
CHEMICAL LAND21[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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