20-Hydroxy-N-acetylleukotriene E4
Basic information
- CAS
107701-63-3- Standard SMILES
CC(=O)NC(CS[C@H](/C=C/C=C/C=C\C/C=C\CCCCCO)[C@@H](O)CCCC(=O)O)C(=O)O- InChIKey
UZPKZFXYHDIVQF-AHKZIMAMSA-N- Molecular formula
- C25H39NO7S
- Average molar mass
- 497.6 g/mol
- Monoisotopic mass
- 497.24472376
Overview
metabolite of leukotriene C4
Names & identifiers
- Preferred name
- 20-Hydroxy-N-acetylleukotriene E4
- IUPAC
- (5S,6R,7E,9E,11Z,14Z)-6-(2-acetamido-2-carboxyethyl)sulfanyl-5,20-dihydroxyicosa-7,9,11,14-tetraenoic acid
Names & synonyms
20-Hydroxy-N-acetylleukotriene E4RefChem:89570107701-63-3N-Ac-w-OH-Lte4N-Acetyl-omega-hydroxyleukotriene E4
Database identifiers
- CAS
107701-63-3- PubChem CID
- 6444129
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 169 Ų
- Hydrogen bond donors
- 5
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 20
- Heavy atoms
- 34
- Formal charge
- 0
- Complexity
- 703
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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