8(9)-EET Ethanolamide

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Systematic / IUPAC Name: (5Z)-N-(2-Hydroxyethyl)-7-{(2S,3R)-3-[(2Z,5Z)-2,5-undecadien-1-yl]-2-oxiranyl}-5-heptenamide

ID: Reference4415

Other Names: N-(2-Hydroxyethyl)-8(9)-epoxy-5Z,11Z,14Z-eicosatrienoic amide;
5-Heptenamide, N-(2-hydroxyethyl)-7-{(2S,3R)-3-[(2Z,5Z)-2,5-undecadien-1-yl]oxiranyl}, (5Z)-

Formula: C22H37NO3

Class: Endogenous Metabolites

Spectral Data

8(9)-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 77
Tandem Spectra MS1, MS2
Ionization Methods NSI
Analyzers FT
Last Modification 4/4/2016 10:44:00 AM
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Identificators

InChI InChI=1S/C22H37NO3/c1-2-3-4-5-6-7-8-9-12-15-20-21(26-20)16-13-10-11-14-17-22(25)23-18-19-24/h6-7,9-10,12-13,20-21,24H,2-5,8,11,14-19H2,1H3,(H,23,25)/b7-6-,12-9-,13-10-/t20-,21+/m1/s1
InChI Key BXHPMUQFGGSDAK-PDFUHZMOSA-N
Canonical SMILES CCCCCC=CCC=CCC1C(O1)CC=CCCCC(=O)NCCO
CAS
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Other Names N-(2-Hydroxyethyl)-8(9)-epoxy-5Z,11Z,14Z-eicosatrienoic amide;
5-Heptenamide, N-(2-hydroxyethyl)-7-{(2S,3R)-3-[(2Z,5Z)-2,5-undecadien-1-yl]oxiranyl}, (5Z)-

In Other Databases

ChemSpider 29342137
PubChem 35027601