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Chemical structure of (±)9-HpODE

GC40356

(±)9-HpODE

Also known as (10E,12Z)-9-hydroperoxyoctadeca-10,12-dienoic acid

(±)9-HpODE is a racemic mixture of the fatty acid hydroperoxide product (9(S)-HpODE) formed from lipoxygenase action on linoleic acid

ChemicalCAS5502-91-0MW312.4FormulaC18H32O4
CAS number
5502-91-0
Molecular weight
312.4
Formula
C18H32O4
Solubility
DMF： >50 mg/ml (per 9(S)–HpODE),DMSO： >50 mg/ml (per 9(S)–HpODE),Ethanol： >50 mg/ml (per 9(S)–HpODE),PBS (pH 7·2)： >1 mg/ml (from 13(S)–HODE)
InChIKey
JGUNZIWGNMQSBM-ZJHFMPGASA-N
Catalogue number
GC40356
Brand
GLPBIO
Computed properties PubChem CID 6439847 · XLogP 5.4 · TPSA 66.8 Ų · H-bond donors 2
XLogP
5.4
TPSA
66.8 Ų
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
15
Heavy atoms
22

SMILES CCCCC/C=C\C=C\C(CCCCCCCC(=O)O)OO

Computed descriptors from PubChem (CID 6439847), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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