(+/-)9-HODE

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Systematic / IUPAC Name: (10E,12E)-9-Hydroxy-10,12-octadecadienoic acid

ID: Reference9776

Other Names: Dimorphecolic acid;
(10E,12E)-9-Hydroxyoctadeca-10,12-dienoic acid;
10,12-Octadecadienoic acid, 9-hydroxy-;
9-Hydroxy-10,12-octadecadienoate;
9-Hydroxy-10,12-octadecadienoic acid ; more

Formula: C18H32O3

Class: Endogenous Metabolites

Spectral Data

(+/-)9-HODE 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 478
Tandem Spectra MS1, MS2, MS3
Ionization Methods NSI
Analyzers FT
Last Modification 6/18/2020 10:50:15 AM
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Identificators

InChI InChI=1S/C18H32O3/c1-2-3-4-5-6-8-11-14-17(19)15-12-9-7-10-13-16-18(20)21/h6,8,11,14,17,19H,2-5,7,9-10,12-13,15-16H2,1H3,(H,20,21)/b8-6+,14-11+
InChI Key NPDSHTNEKLQQIJ-SIGMCMEVSA-N
Canonical SMILES CCCCCC=CC=CC(CCCCCCCC(=O)O)O
CAS 98524197
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Other Names Dimorphecolic acid;
(10E,12E)-9-Hydroxyoctadeca-10,12-dienoic acid;
10,12-Octadecadienoic acid, 9-hydroxy-;
9-Hydroxy-10,12-octadecadienoate;
9-Hydroxy-10,12-octadecadienoic acid;
9-Hydroxy-10E,12E-octadecadienoate;
9-Hydroxy-10E,12E-octadecadienoic acid;
9-Hydroxy-trans-10,trans-12-octadecadienoate;
9-Hydroxy-trans-10,trans-12-octadecadienoic acid;
(+/-)-9-hydroxy-10E,12Z-octadecadienoic acid

In Other Databases

ChemSpider 4446072
ChEMBL CHEMBL457771
ChemIDPlus 015514859
HMDb HMDB0010223
PubChem 5282945