Basic information
- Standard SMILES
CC[C@@H](C)[C@@H](NC(=O)[C@@H](N)CC(=O)O)C(=O)N[C@@H](COC)c1ccccc1- InChIKey
ASZMNLMVXZOUJB-VWNJHIHFSA-N- Molecular formula
- C19H29N3O5
- Average molar mass
- 379.5 g/mol
Names & identifiers
- Preferred name
- alpha-L-aspartyl-D-isoleucine (R)-alpha-methoxymethylbenzylamide
- IUPAC
- (3S)-3-amino-4-[[(2R,3R)-1-[[(1R)-2-methoxy-1-phenylethyl]amino]-3-methyl-1-oxopentan-2-yl]amino]-4-oxobutanoic acid
Names & synonyms
ASZMNLMVXZOUJB-VWNJHIHFSA-Nalpha-L-aspartyl-D-isoleucine (R)-alpha-methoxymethylbenzylamide
Database identifiers
- PubChem CID
- 53660612
Properties
Computed structural properties
- XLogP
- -1.7
- Topological polar surface area
- 131 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 11
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 494
Related reactions
1 records
Linked notes
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