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Chemical structure of 5(S),6(R)-11-trans DiHETE

GC41128

5(S),6(R)-11-trans DiHETE

Also known as (5S,6R,7E,9E,11E,14Z)-5,6-dihydroxyicosa-7,9,11,14-tetraenoic acid

5(S),6(R)-11-trans DiHETE is a C-11 double bond isomer of 5(S),6(R)-DiHETE that is formed by the enzymatic isomerization of 5(S),6(R)-DiHETE by a membrane bound factor

ChemicalCAS129263-59-8MW336.5FormulaC20H32O4
CAS number
129263-59-8
Molecular weight
336.5
Formula
C20H32O4
Solubility
DMF： 50 mg/ml,DMSO： 50 mg/ml,Ethanol： 50 mg/ml,PBS (pH 7·2)： 1 mg/ml
InChIKey
UVZBUUTTYHTDRR-QLMKOMRNSA-N
Catalogue number
GC41128
Brand
GLPBIO
Computed properties PubChem CID 124518516 · XLogP 4.3 · TPSA 77.8 Ų · H-bond donors 3
XLogP
4.3
TPSA
77.8 Ų
H-bond donors
3
H-bond acceptors
4
Rotatable bonds
14
Heavy atoms
24

SMILES CCCCC/C=C\C/C=C/C=C/C=C/[C@H]([C@H](CCCC(=O)O)O)O

Computed descriptors from PubChem (CID 124518516), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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