(+/-)11(12)-EET

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Systematic / IUPAC Name: (5Z,8Z)-10-{(2S,3R)-3-[(2Z)-2-Octen-1-yl]-2-oxiranyl}-5,8-decadienoic acid

ID: Reference9807

Other Names: (11S,12R)-Epoxy-(5Z,8Z,14Z)-eicosatrienoic acid;
(11S,12R)-Epoxy-(5Z,8Z,14Z)-icosatrienoic acid;
(5Z,8Z)-10-{(2S,3R)-3-[(2Z)-Oct-2-en-1-yl]oxiran-2-yl}deca-5,8-dienoic acid;
(5Z,8Z,14Z)-cis-11,12-Epoxy-5,8,14-eicosatrienoic acid;
11(S),12(R)-EET ; more

Formula: C20H32O3

Class: Endogenous Metabolites

Spectral Data

(+/-)11(12)-EET mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

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Available MS Data

Used Instruments Orbitrap Fusion with FAIMS
No. of Spectral Trees 2
No. of Spectra 1727
Tandem Spectra MS1, MS2, MS3, MS4
Ionization Methods NSI
Analyzers FT
Last Modification 7/2/2020 4:36:53 PM
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Identificators

InChI InChI=1S/C20H32O3/c1-2-3-4-5-9-12-15-18-19(23-18)16-13-10-7-6-8-11-14-17-20(21)22/h6,8-10,12-13,18-19H,2-5,7,11,14-17H2,1H3,(H,21,22)/b8-6-,12-9-,13-10-/t18-,19+/m1/s1
InChI Key DXOYQVHGIODESM-LZXKBWHHSA-N
Canonical SMILES CCCCCC=CCC1C(O1)CC=CCC=CCCCC(=O)O
CAS 123931408
Splash
Other Names (11S,12R)-Epoxy-(5Z,8Z,14Z)-eicosatrienoic acid;
(11S,12R)-Epoxy-(5Z,8Z,14Z)-icosatrienoic acid;
(5Z,8Z)-10-{(2S,3R)-3-[(2Z)-Oct-2-en-1-yl]oxiran-2-yl}deca-5,8-dienoic acid;
(5Z,8Z,14Z)-cis-11,12-Epoxy-5,8,14-eicosatrienoic acid;
11(S),12(R)-EET;
11(S),12(R)-EpETrE;
(+/-)11,12-EpETrE;
(+/-)11,(12)-Epoxy-5Z,8Z,14Z-eicosatrienoic acid

In Other Databases

ChemSpider 23208913
ChEBI CHEBI:132276
PubChem 40490664
ChEMBL CHEMBL128117