LIPID MAPS

Structure Database (LMSD)

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Common Name

Ectocarpin C

Systematic Name

(5Z,8Z,11Z)-12-{(1'R,2'S,3'S,5'S)-3-[(1''E)-1''-hydroxypropyl]-6'-oxabicyclo[3.1.0]hex-2'-yl}-5,8,11-dodecatrienoic acid

Synonyms

LM ID

LMFA04000105

Formula

C₂₀H₃₀O₄

Exact Mass

Calculate m/z

334.21441

Sum Composition

FA 20:5;O2

Status

Active

Show lipids differing only in stereochemistry/bond geometry

Main

Classification

String Representations

InChiKey (Click to copy)

JXYOANMVJXRDSA-LUZGOERCSA-N

InChi (Click to copy)

InChI=1S/C20H30O4/c1-2-17(21)16-14-18-20(24-18)15(16)12-10-8-6-4-3-5-7-9-11-13-19(22)23/h4-7,10,12,15-18,20-21H,2-3,8-9,11,13-14H2,1H3,(H,22,23)/b6-4-,7-5-,12-10-/t15-,16+,17-,18-,20+/m0/s1

SMILES (Click to copy)

[C@H]12O[C@H]1C[C@@]([H])([C@@H](O)CC)[C@@H]2/C=C\C/C=C\C/C=C\CCCC(=O)O

References

Comments

Submitted by A.N.Grechkin

Taxonomy Information

Curated from

NCBI taxonomy class

Reference

Ectocarpus siliculosus (#2880)

Phaeophyceae (#2870)

Lipoxygenase pathway in brown algae: The biosynthesis of novel oxylipins 'ectocarpins' by hydroperoxide bicyclase CYP5164A3 of Ectocarpus siliculosus.,
Biochim Biophys Acta Mol Cell Biol Lipids, 2022

Pubmed ID: 35835431