LIPID MAPS

Structure Database (LMSD)

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Common Name

Fucoxanthinol 3-heptadecanoate 3'-myristate

Systematic Name

Fucoxanthinol 3-heptadecanoate 3'-tetradecanoate

Synonyms

17:0FOH14:0

LM ID

LMPR01070357

Formula

C₇₁H₁₁₄O₇

Exact Mass

Calculate m/z

1078.856455

Status

Active

Show lipids differing only in stereochemistry/bond geometry

Main

Classification

String Representations

InChiKey (Click to copy)

BOOOCNVKBTYCOU-XFPHYSFESA-N

InChi (Click to copy)

InChI=1S/C71H114O7/c1-13-15-17-19-21-23-25-26-27-29-31-33-34-36-48-65(73)76-61-52-67(7,8)64(69(11,75)54-61)51-50-59(5)45-40-44-57(3)42-38-39-43-58(4)46-41-47-60(6)63(72)56-71-68(9,10)53-62(55-70(71,12)78-71)77-66(74)49-37-35-32-30-28-24-22-20-18-16-14-2/h38-47,50,61-62,75H,13-37,48-49,52-56H2,1-12H3/b39-38+,44-40+,46-41+,57-42+,58-43+,59-45+,60-47+/t51-,61-,62-,69+,70+,71-/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@@]=C3[C@@](O)(C)C[C@@H](OC(=O)CCCCCCCCCCCCCCCC)C[C@]3(C)C)\C)O[C@]1(C)C[C@@H](OC(CCCCCCCCCCCCC)=O)C[C@@]2(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