Des-enkephalin-gamma-endorphin
Basic information
- CAS
74174-40-6- Standard SMILES
CC(C)C[C@H](NC(=O)C(NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)C(CCC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CO)NC(=O)[C@@H](N)[C@@H](C)O)[C@@H](C)O)C(C)C)[C@@H](C)O)C(=O)O- InChIKey
IBMGLBKMRBRJJT-YDKHIEAGSA-N- Molecular formula
- C56H98N14O21
- Average molar mass
- 1,303.5 g/mol
- Monoisotopic mass
- 1,302.70309619
Names & identifiers
- Preferred name
- Des-enkephalin-gamma-endorphin
- IUPAC
- (2S)-2-[[(3R)-2-[[(2S)-2-[[(2S)-2-[[(2S)-1-[(2S,3R)-2-[[5-amino-2-[[(2S)-2-[[(2S)-6-amino-2-[[(2S)-2-[[(2S)-2-[[(2S,3R)-2-amino-3-hydroxybutanoyl]amino]-3-hydroxypropanoyl]amino]-4-carboxybutanoyl]amino]hexanoyl]amino]-3-hydroxypropanoyl]amino]-5-oxopentanoyl]amino]-3-hydroxybutanoyl]pyrrolidine-2-carbonyl]amino]-4-methylpentanoyl]amino]-3-methylbutanoyl]amino]-3-hydroxybutanoyl]amino]-4-methylpentanoic acid
- English name
- des-enkephalin-gamma-endorphin
- Molecular formula
- C56H98N14O21
- Molecular weight
- 1303.45852
Names & synonyms
Degammaebeta-Endorphin(6-17)beta-Lipotropin 66-77beta-Lph(66-77)des-enkephalin-gamma-endorphinOrg-587874174-40-6alpha-Endorphin, 1-de-L-tyrosine-2-deglycine-3-deglycine-4-de-L-phenylalanine-5-de-L-methionine-16a-L-leucine-RefChem:132102Org 5878SCHEMBL31734555
Database identifiers
- CAS
74174-40-6- PubChem CID
- 123641
Properties
Computed structural properties
- XLogP
- -10
- Topological polar surface area
- 582 Ų
- Hydrogen bond donors
- 20
- Hydrogen bond acceptors
- 23
- Rotatable bonds
- 42
- Heavy atoms
- 91
- Formal charge
- 0
- Complexity
- 2,510
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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