(+/-)19(20)-DiHDPA

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Systematic / IUPAC Name: (4Z,7Z,10Z,13Z,16Z,19S,20R)-19,20-Dihydroxydocosa-4,7,10,13,16-pentaenoic acid

ID: Reference9775

Other Names: (+/-)19,20-dihydroxy-4Z,7Z,10Z,13Z,16Z-docosapentaenoic acid

Formula: C22H34O4

Class: Endogenous Metabolites

Spectral Data

(+/-)19(20)-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 325
Tandem Spectra MS1, MS2, MS3, MS4
Ionization Methods NSI
Analyzers FT
Last Modification 6/18/2020 10:48:12 AM
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Identificators

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

In Other Databases

PubChem 35026900
ChemSpider 29341371