Basic information
- CAS
77217-02-8- Standard SMILES
C[C@H](O)[C@@H](NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)NCC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CC=C[C@H]1C(N)=O- InChIKey
JUQWQKWBESTGLP-COPJJLTNSA-N- Molecular formula
- C29H36N6O7
- Average molar mass
- 580.6 g/mol
- Monoisotopic mass
- 580.26454751
Overview
potent enkephalin analog
Names & identifiers
- Preferred name
- Enkephalinamide, thr(2)-delta(3)pro(5)-
- IUPAC
- (2S)-1-[(2S)-2-[[2-[[(2R,3S)-2-[[(2S)-2-amino-3-(4-hydroxyphenyl)propanoyl]amino]-3-hydroxybutanoyl]amino]acetyl]amino]-3-phenylpropanoyl]-2,5-dihydropyrrole-2-carboxamide
- English name
- enkephalinamide, Thr(2)-delta(3)Pro(5)-
- Molecular formula
- C29H36N6O7
- Molecular weight
- 580.63
Names & synonyms
Tyr-thr-gly-phe-delta(3)pro-NH22-Thr-5-delta(3)-pro-enkephalinamideEnkephalinamide, thr(2)-delta(3)pro(5)-Enkephalinamide, threonyl(2)-delta(3)-proline(5)-Tyrosyl-threonyl-glycyl-phenylalanyl-delta(3)-prolinamide77217-02-8RefChem:136923L-Tyrosyl-D-threonylglycyl-L-phenylalanyl-3,4-didehydro-L-prolinamideL-Prolinamide, L-tyrosyl-D-threonylglycyl-L-phenylalanyl-3,4-didehydro-L-Prolinamide, L-tyrosyl-D-threonylglycyl-L-phenylalanyl-3,4-didehydro- (9CI)
Database identifiers
- CAS
77217-02-8- PubChem CID
- 129010907
Properties
Computed structural properties
- XLogP
- -0.4
- Topological polar surface area
- 217 Ų
- Hydrogen bond donors
- 7
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 13
- Heavy atoms
- 42
- Formal charge
- 0
- Complexity
- 993
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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