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7,11,13,16,19-Docosapentaenoic acid, 10-hydroxy-, methyl ester, [R-(E,Z,Z,Z,Z)]-
SpectraBase Compound ID 1QcOR5flgYB
InChI InChI=1S/C23H36O3/c1-3-4-5-6-7-8-9-10-13-16-19-22(24)20-17-14-11-12-15-18-21-23(25)26-2/h4-5,7-8,10,13-14,16-17,19,22,24H,3,6,9,11-12,15,18,20-21H2,1-2H3/b5-4-,8-7-,13-10-,17-14+,19-16-/t22-/m0/s1
InChIKey ASDVBLDKFHDZRJ-NVRRWVNVSA-N
Mol Weight 360.5 g/mol
Molecular Formula C23H36O3
Exact Mass 360.266445 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 61rJDIS1H7o
Name 7,11,13,16,19-Docosapentaenoic acid, 10-hydroxy-, methyl ester, [R-(E,Z,Z,Z,Z)]-
CAS Registry Number 117333-03-6
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H36O3
InChI InChI=1S/C23H36O3/c1-3-4-5-6-7-8-9-10-13-16-19-22(24)20-17-14-11-12-15-18-21-23(25)26-2/h4-5,7-8,10,13-14,16-17,19,22,24H,3,6,9,11-12,15,18,20-21H2,1-2H3/b5-4-,8-7-,13-10-,17-14+,19-16-/t22-/m0/s1
InChIKey ASDVBLDKFHDZRJ-NVRRWVNVSA-N
Molecular Weight 360.538 g/mol
SMILES O[C@@](\C=C/C=C\C\C=C/C\C=C/CC)(C\C=C\CCCCCC(=O)OC)[H]
SPLASH splash10-0006-9001000000-440a4af1e3f9ba519d35
Source of Spectrum H-71-1098-0
Synonyms Methyl (+)-(10R,7Z,11E,13Z,16Z,19Z)-10-hydroxy-7,11,13,16,19-docosapentaenoate methyl (7E,10R,11Z,13Z,16Z,19Z)-10-hydroxy-7,11,13,16,19-docosapentaenoate
Wiley ID 1348658