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Chemical structure of 9(S)-HpODE

GC40357

9(S)-HpODE

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

9(S)-HpODE is produced by the action of arachidonate 5-LO on linoleic acid

ChemicalCAS29774-12-7MW312.4FormulaC18H32O4
CAS number
29774-12-7
Molecular weight
312.4
Formula
C18H32O4
Solubility
DMF: >50 mg/ml (per Rao Maddipati),DMSO: >50 mg/ml (per Rao Maddipati),Ethanol: >50 mg/ml (per Rao Maddipati),PBS pH 7·2: >1 mg/ml (from 13(S)–HODE)
InChIKey
JGUNZIWGNMQSBM-UINYOVNOSA-N
Catalogue number
GC40357
Brand
GLPBIO
Computed properties PubChem CID 9548877 · 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@H](CCCCCCCC(=O)O)OO

Computed descriptors from PubChem (CID 9548877), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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