enkephalin, dehydro-Ala(3)-
Basic information
- CAS
81851-82-3- Standard SMILES
C=C(NC(=O)CNC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(C)C)C(=O)O- InChIKey
ZGDPUCIKMASGRG-HJOGWXRNSA-N- Molecular formula
- C29H37N5O7
- Average molar mass
- 567.6 g/mol
- Monoisotopic mass
- 567.26929854
Overview
potent enkephalin analog for the delta opiate receptor
Names & identifiers
- Preferred name
- enkephalin, dehydro-Ala(3)-
- IUPAC
- (2S)-2-[[(2S)-2-[2-[[2-[[(2S)-2-amino-3-(4-hydroxyphenyl)propanoyl]amino]acetyl]amino]prop-2-enoylamino]-3-phenylpropanoyl]amino]-4-methylpentanoic acid
- English name
- enkephalin, dehydro-Ala(3)-
- Molecular formula
- C29H37N5O7
- Molecular weight
- 567.63338
Names & synonyms
Enkephalin, dehydro-ala(3)-3-Dehydro-ala-enkephalinEnkephalin, dehydroalalnine(3)-81851-82-3DTXSID00231413L-Leucine, N-(N-(2,3-didehydro-N-(N-L-tyrosylglycyl)alanyl)-L-phenylalanyl)-RefChem:136869DTXCID00153904N-{2-[(L-Tyrosylglycyl)amino]prop-2-enoyl}-L-phenylalanyl-L-leucine
Database identifiers
- CAS
81851-82-3- PubChem CID
- 196208
- DTXSID
DTXSID00231413
Properties
Computed structural properties
- XLogP
- -1.7
- Topological polar surface area
- 200 Ų
- Hydrogen bond donors
- 7
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 15
- Heavy atoms
- 41
- Formal charge
- 0
- Complexity
- 927
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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