Basic information
- CAS
56104-03-1- Standard SMILES
NC(=O)CC[C@H](NCCc1ccc(O)c(O)c1)C(=O)O- InChIKey
BRFMSFVCMXMBKH-VIFPVBQESA-N- Molecular formula
- C13H18N2O5
- Average molar mass
- 282.29 g/mol
- Monoisotopic mass
- 282.12157168
Names & identifiers
- Preferred name
- gamma-Glutamyl dopamine
- IUPAC
- (2S)-5-amino-2-[2-(3,4-dihydroxyphenyl)ethylamino]-5-oxopentanoic acid
- English name
- gamma-glutamyl dopamine
- Molecular formula
- C13H18N2O5
- Molecular weight
- 282.29
Names & synonyms
gamma-Glutamyl dopaminegamma-GlutamyldopamineL-Glutamine, N-(2-(3,4-dihydroxyphenyl)ethyl)-56104-03-1gamma-Glutamyl dopamideL-gamma-GlutamyldopamineRefChem:142306(2S)-5-amino-2-[2-(3,4-dihydroxyphenyl)ethylamino]-5-oxopentanoic acidSCHEMBL10603786DTXSID60971489N-[2-(3,4-Dihydroxyphenyl)ethyl]-5-hydroxy-5-iminonorvalineN-[2-(3,4-Dihydroxyphenyl)ethyl]-5-hydroxy-5-imino-L-norvaline
Show more names
L-Glutamine, N-[2-(3,4-dihydroxyphenyl)ethyl]-
Database identifiers
- CAS
56104-03-1- PubChem CID
- 194012
- DTXSID
DTXSID60971489
Properties
Computed structural properties
- XLogP
- -2.4
- Topological polar surface area
- 133 Ų
- Hydrogen bond donors
- 5
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 8
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 337
Physicochemical properties
- Boiling point
- 653.617 · 653.617±55.00 °C(Press: 760.00 Torr)(predicted)
- Density
- 1.369 · 1.369±0.06 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
- pka
- 2.224 · 2.224±0.10(predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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