15-Hydroxyicosa-5,8,11,13-tetraenoic acid

HCID 1436

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Basic information

CAS: 73945-47-8
Standard SMILES: CCCCCC(O)C=CC=CCC=CCC=CCCCC(=O)O
InChIKey: JSFATNQSLKRBCI-UHFFFAOYSA-N
Molecular formula: C20H32O3
Average molar mass: 320.5 g/mol
Monoisotopic mass: 320.23514488

Names & identifiers

Preferred name: 15-Hydroxyicosa-5,8,11,13-tetraenoic acid
IUPAC: 15-hydroxyicosa-5,8,11,13-tetraenoic acid

Names & synonyms

15-hydroxyicosa-5,8,11,13-tetraenoic acidDTXSID20866448RefChem:236610DTXCID10814731(+/-)15-HETE15(S)-HETE-d8HETE-15(S)15-Hydroxyeicosa-5,8,11,13-tetraenoic acidSCHEMBL1478266JDA80787WCA03036DB-052655

Database identifiers

CAS: 73945-47-8
PubChem CID: 1436
DTXSID: DTXSID20866448

Properties

Computed structural properties

XLogP: 5.1
Topological polar surface area: 57.5 Å²
Hydrogen bond donors: 2
Hydrogen bond acceptors: 3
Rotatable bonds: 14
Heavy atoms: 23
Formal charge: 0
Complexity: 392

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