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Chemical structure of 4,5-DiHDPA lactone

GC41201

4,5-DiHDPA lactone

Also listed as (±)4(5)-DiHDPA lactone

(±)5(6)-DiHET lactone is a 1,5 cyclic ester derived from (±)5(6)-DiHET, which, in turn, is a potential derivative of epoxidation of arachidonic acid at the α-5 double bond

ChemicalCAS845673-68-9MW344.5FormulaC22H32O3
CAS number
845673-68-9
Molecular weight
344.5
Formula
C22H32O3
Solubility
DMF: 30 mg/mL,DMSO: 25 mg/mL,Ethanol: 30 mg/mL,Ethanol:PBS (pH 7·2)(1:2): 0·3 mg/mL
InChIKey
PCOBNCGOHMJRLU-VSHOBBMYSA-N
Catalogue number
GC41201
Brand
GLPBIO
Computed properties PubChem CID 124582080 · XLogP 5.2 · TPSA 46.5 Ų · H-bond donors 1
XLogP
5.2
TPSA
46.5 Ų
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
12
Heavy atoms
25

SMILES CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\C[C@H]([C@@H]1CCC(=O)O1)O

Computed descriptors from PubChem (CID 124582080), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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