(+/-)7(8)-DiHDPA

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Systematic / IUPAC Name: (4Z,7S,8R,10Z,13Z,16Z,19Z)-7,8-Dihydroxydocosa-4,10,13,16,19-pentaenoic acid

ID: Reference9761

Other Names: (+/-)7,8-Dihydroxydocosa-4Z,10Z,13Z,16Z,19Z-pentaenoic acid

Formula: C22H34O4

Class: Endogenous Metabolites

Spectral Data

(+/-)7(8)-DiHDPA 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 163
Tandem Spectra MS1, MS2, MS3
Ionization Methods NSI
Analyzers FT
Last Modification 6/12/2020 6:35:58 AM
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Identificators

InChI InChI=1S/C22H34O4/c1-2-3-4-5-6-7-8-9-10-11-12-14-17-20(23)21(24)18-15-13-16-19-22(25)26/h3-4,6-7,9-10,12-15,20-21,23-24H,2,5,8,11,16-19H2,1H3,(H,25,26)/b4-3-,7-6-,10-9-,14-12-,15-13-/t20-,21+/m1/s1
InChI Key DPZIOENSPXELQY-JYFGGXQQSA-N
Canonical SMILES CCC=CCC=CCC=CCC=CCC(C(CC=CCCC(=O)O)O)O
CAS 168111931
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Other Names (+/-)7,8-Dihydroxydocosa-4Z,10Z,13Z,16Z,19Z-pentaenoic acid

In Other Databases

PubChem 129364489
ChemSpider 68004089