5-Hydroperoxyicosa-6,8,11,14-tetraenoic acid

HCID 1772

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Basic information

CAS: 74581-83-2
Standard SMILES: CCCCCC=CCC=CCC=CC=CC(CCCC(=O)O)OO
InChIKey: JNUUNUQHXIOFDA-UHFFFAOYSA-N
Molecular formula: C20H32O4
Average molar mass: 336.5 g/mol
Monoisotopic mass: 336.2300595

Overview

5-Hydroperoxyicosa-6,8,11,14-tetraenoic acid has been reported in Homo sapiens with data available.

Names & identifiers

Preferred name: 5-Hydroperoxyicosa-6,8,11,14-tetraenoic acid
IUPAC: 5-hydroperoxyicosa-6,8,11,14-tetraenoic acid

Names & synonyms

5-hydroperoxyicosa-6,8,11,14-tetraenoic acidRefChem:30333874581-83-25-Hydroperoxy-6,8,11,14-eicosatetraenoic acidSCHEMBL6905374DTXSID30868034WCA77408PD0259935-hydroperoxy-6,8,11,14 eicosatetraenoic acid

Database identifiers

CAS: 74581-83-2
PubChem CID: 1772
DTXSID: DTXSID30868034

Properties

Computed structural properties

XLogP: 5.3
Topological polar surface area: 66.8 Å²
Hydrogen bond donors: 2
Hydrogen bond acceptors: 4
Rotatable bonds: 15
Heavy atoms: 24
Formal charge: 0
Complexity: 408

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