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Methyl 10(S),11(R)-Trihydroxyeicosa-5,8,14(Z)-trienoate
SpectraBase Compound ID 1VBmzzy6irL
InChI InChI=1S/C21H36O5/c1-3-4-5-6-9-12-15-18(22)21(25)19(23)16-13-10-7-8-11-14-17-20(24)26-2/h7-9,12-13,16,18-19,21-23,25H,3-6,10-11,14-15,17H2,1-2H3/b8-7-,12-9-,16-13-/t18-,19+,21-/m1/s1
InChIKey XFNYJCFBWCYBOW-YVFKZHSOSA-N
Mol Weight 368.5 g/mol
Molecular Formula C21H36O5
Exact Mass 368.256274 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Iv5HRXn2F59
Name Methyl 10(S),11(R)-Trihydroxyeicosa-5,8,14(Z)-trienoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H36O5
InChI InChI=1S/C21H36O5/c1-3-4-5-6-9-12-15-18(22)21(25)19(23)16-13-10-7-8-11-14-17-20(24)26-2/h7-9,12-13,16,18-19,21-23,25H,3-6,10-11,14-15,17H2,1-2H3/b8-7-,12-9-,16-13-/t18-,19+,21-/m1/s1
InChIKey XFNYJCFBWCYBOW-YVFKZHSOSA-N
Molecular Weight 368.514 g/mol
SMILES O[C@]([C@@]([C@](O)(C\C=C/CCCCC)[H])(O)[H])(\C=C/C\C=C/CCCC(=O)OC)[H]
SPLASH splash10-001i-9006000000-e81387d34282d3ce0029
Source of Spectrum J-58-2761-3
Synonyms Methyl 10(S),11,12(R)-Trihydroxyeicosa-5,8,14(Z)-trienoate Methyl (5Z,8Z,10S,11R,12R,14Z)-10,11,12-trihydroxyicosa-5,8,14-trienoate Methyl (5Z,8Z,10S,11R,12R,14Z)-10,11,12-tris(oxidanyl)icosa-5,8,14-trienoate
Wiley ID 1353171