LIPID MAPS

Structure Database (LMSD)

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Systematic Name

2R-(1'S-methyl-5'Z,8'Z-octadecadienyl)-1,3-dioxolan-4S-yl-methanol

Synonyms

LM ID

LMFA12000404

Formula

C₂₃H₄₂O₃

Exact Mass

Calculate m/z

366.313395

Status

Active

Show lipids differing only in stereochemistry/bond geometry

Main

Classification

String Representations

InChiKey (Click to copy)

ZTXFUNCERCMBJD-MRQZSVMOSA-N

InChi (Click to copy)

InChI=1S/C23H42O3/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-21(2)23-25-20-22(19-24)26-23/h11-12,14-15,21-24H,3-10,13,16-20H2,1-2H3/b12-11-,15-14-/t21-,22-,23+/m0/s1

SMILES (Click to copy)

[C@@H]1(CO)O[C@](OC1)([H])[C@@H](C)CCC/C=C\C/C=C\CCCCCCCCC

References

Taxonomy Information

Curated from

NCBI taxonomy class

Reference

Leucetta sp. (#81546)

Calcarea (#27929)

Structure Determination of 1,3-Dioxolane-Containing Lipids from the Marine Sponge Leucetta sp. Using Chiral ¹H NMR Analysis of Model Systems.,
J Nat Prod, 2024

Pubmed ID: 39018480