(+/-)9(10)-EpOME

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

ID: Reference9808

Other Names: (+/-)-cis-9,10-Epoxy-12(Z)-octadecenoic acid;
(+/-)9,10-Epoxy-12Z-octadecenoic acid;
Coronaric Acid;
(+/-)9,10-EODE;
Leukotoxin

Formula: C18H32O3

Class: Endogenous Metabolites

Spectral Data

(+/-)9(10)-EpOME 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 1
No. of Spectra 426
Tandem Spectra MS1, MS2, MS3
Ionization Methods NSI
Analyzers FT
Last Modification 7/2/2020 4:40:26 PM
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Identificators

InChI InChI=1S/C18H32O3/c1-2-3-4-5-7-10-13-16-17(21-16)14-11-8-6-9-12-15-18(19)20/h7,10,16-17H,2-6,8-9,11-15H2,1H3,(H,19,20)/b10-7-/t16-,17+/m1/s1
InChI Key FBUKMFOXMZRGRB-XKJZPFPASA-N
Canonical SMILES CCCCCC=CCC1C(O1)CCCCCCCC(=O)O
CAS
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Other Names (+/-)-cis-9,10-Epoxy-12(Z)-octadecenoic acid;
(+/-)9,10-Epoxy-12Z-octadecenoic acid;
Coronaric Acid;
(+/-)9,10-EODE;
Leukotoxin

In Other Databases

PubChem 12097313
ChemSpider 29341383