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Chemical structure of (±)17(18)-EpETE methyl ester

GC41318

(±)17(18)-EpETE methyl ester

Also known as methyl (5Z,8Z,11Z,14Z)-16-[(2S,3R)-3-ethyloxiran-2-yl]hexadeca-5,8,11,14-tetraenoate

(±)17(18)-EpETE methyl ester is an analog of the eicosapentaenoic acid (EPA) metabolite (±)17(18)-EpETE that is more lipid soluble

ChemicalCAS141339-46-0MW332.5FormulaC21H32O3
CAS number
141339-46-0
Molecular weight
332.5
Formula
C21H32O3
Solubility
DMF： 50 mg/ml,DMSO： 50 mg/ml,Ethanol： 50 mg/ml,PBS (pH 7·2)： 1 mg/ml
InChIKey
WXPZUUKQJWLIOW-FMVRBZNTSA-N
Catalogue number
GC41318
Brand
GLPBIO
Computed properties PubChem CID 102020824 · XLogP 5.1 · TPSA 38.8 Ų · H-bond donors 0
XLogP
5.1
TPSA
38.8 Ų
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
14
Heavy atoms
24

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

Computed descriptors from PubChem (CID 102020824), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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