11(12)-EET ethanolamide

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Systematic / IUPAC Name: (5Z,8Z)-N-(2-Hydroxyethyl)-10-{(2S,3R)-3-[(2Z)-2-octen-1-yl]-2-oxiranyl}-5,8-decadienamide

ID: Reference4409

Other Names: N-(2-Hydroxyethyl)-11(12)-epoxy-5Z,8Z,14Z-eicosatrienamide;
5,8-Decadienamide, N-(2-hydroxyethyl)-10-[(2S,3R)-3-[(2Z)-2-octen-1-yl]oxiranyl], (5Z,8Z)-

Formula: C22H37NO3

Class: Endogenous Metabolites

Spectral Data

11(12)-EET ethanolamide 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 Elite
No. of Spectral Trees 1
No. of Spectra 72
Tandem Spectra MS1, MS2
Ionization Methods NSI
Analyzers FT
Last Modification 4/4/2016 8:32:33 AM
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Identificators

InChI InChI=1S/C22H37NO3/c1-2-3-4-5-9-12-15-20-21(26-20)16-13-10-7-6-8-11-14-17-22(25)23-18-19-24/h6,8-10,12-13,20-21,24H,2-5,7,11,14-19H2,1H3,(H,23,25)/b8-6-,12-9-,13-10-/t20-,21+/m1/s1
InChI Key TYRRSRADDAROSO-ABRALVTRSA-N
Canonical SMILES CCCCCC=CCC1C(O1)CC=CCC=CCCCC(=O)NCCO
CAS
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Other Names N-(2-Hydroxyethyl)-11(12)-epoxy-5Z,8Z,14Z-eicosatrienamide;
5,8-Decadienamide, N-(2-hydroxyethyl)-10-[(2S,3R)-3-[(2Z)-2-octen-1-yl]oxiranyl], (5Z,8Z)-

In Other Databases

PubChem 35027619
ChemSpider 29342134