LIPID MAPS

Structure Database (LMSD)

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Common Name

Fucoxanthinol 3-gondoate

Systematic Name

Fucoxanthinol 3-(11Z)-eicosenoate

Synonyms

FOH-3-C20:1
FOH20:1

LM ID

LMPR01070316

Formula

C₆₀H₉₂O₆

Exact Mass

Calculate m/z

908.68939

Status

Active

Show lipids differing only in stereochemistry/bond geometry

Classification

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

String Representations

InChiKey (Click to copy)

GLJPGHMJGPCDKL-BTXUGPNBSA-N

InChi (Click to copy)

InChI=1S/C60H92O6/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/h19-20,29-38,40,51-52,61,64H,12-18,21-28,39,42-46H2,1-11H3/b20-19-,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(CCCCCCCCC/C=C\CCCCCCCC)=O)CC2(C)C