LIPID MAPS

Structure Database (LMSD)

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Common Name

Fucoxanthinol 3-(5Z,8Z,11Z,14Z,17-eicosapentaenoate)

Systematic Name

Fucoxanthinol 3-(5Z,8Z,11Z,14Z,17Z-eicosapentaenoate)

Synonyms

FOH-3-C20:5
FOH20:5

LM ID

LMPR01070317

Formula

C₆₀H₈₄O₆

Exact Mass

Calculate m/z

900.62679

Status

Active

Show lipids differing only in stereochemistry/bond geometry

Main

Classification

String Representations

InChiKey (Click to copy)

AZNVUGIFIMSMID-YNWVTCJOSA-N

InChi (Click to copy)

InChI=1S/C60H84O6/c1-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28-39-55(63)65-52-44-57(8,9)60(59(11,45-52)66-60)46-53(62)50(5)38-32-37-48(3)34-30-29-33-47(2)35-31-36-49(4)40-41-54-56(6,7)42-51(61)43-58(54,10)64/h13-14,16-17,19-20,22-23,25-26,29-38,40,51-52,61,64H,12,15,18,21,24,27-28,39,42-46H2,1-11H3/b14-13-,17-16-,20-19-,23-22-,26-25-,30-29+,35-31+,37-32+,47-33+,48-34+,49-36+,50-38+/t41-,51-,52-,58+,59+,60-/m0/s1

SMILES (Click to copy)

[C@@]12(CC(=O)/C(/C)=C/C=C/C(/C)=C/C=C/C=C(\C)/C=C/C=C(\C)/C=[C@@]=C3[C@@](O)(C)C[C@@H](O)CC3(C)C)O[C@]1(C)C[C@@H](OC(CCC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CC)=O)CC2(C)C

References

Taxonomy Information

Curated from

NCBI taxonomy class

Reference

Dreissena rostriformis bugensis (#427924)

Bivalvia (#6544)

Separation and identification of fatty acid esters of algal carotenoid metabolites in the freshwater mussel Dreissena bugensis, by liquid chromatography with ultraviolet/visible wavelength and mass spectrometric detectors in series.,
J Chromatogr A, 2017

Pubmed ID: 28750733