Structure Database (LMSD)

Common Name
Methyl octadecanoate
Systematic Name
Methyl octadecanoate
Synonyms
  • WE(1:0/18:0)
LM ID
LMFA07010474
Formula
Exact Mass
Calculate m/z
298.287181
Sum Composition
Status
Curated



Classification

Biological Context

Stearic acid methyl ester is an esterified version of the free acid which is less water soluble but more amenable for the formulation of stearate-containing diets and dietary supplements. Stearic acid is a long-chain saturated fatty acid that can be derived from either animal fats or vegetable oils. Compared to other long-chain saturated fatty acids that are hypercholesterolemic, experimental diets high in stearic acid (9.3-11.8% of energy) do not raise plasma total cholesterol or LDL cholesterol concentrations but may slightly reduce HDL cholesterol concentrations.1,2

This information has been provided by Cayman Chemical

References

References

Comments
Pherobase Semiochemicals

Taxonomy Information

Curated from
NCBI taxonomy class
Reference
Insecta (#50557)
Structural and communicative functions of Dufour's gland secretion in Eucera palestinae (Hymenoptera; Anthophoridae),
Insect Biochem, 1985

String Representations

InChiKey (Click to copy)
HPEUJPJOZXNMSJ-UHFFFAOYSA-N
InChi (Click to copy)
InChI=1S/C19H38O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19(20)21-2/h3-18H2,1-2H3
SMILES (Click to copy)
O=C(CCCCCCCCCCCCCCCCC)OC

Other Databases

HMDB ID
CHEBI ID
PubChem CID
Cayman ID

Calculated Physicochemical Properties

Heavy Atoms 21
Rings 0
Aromatic Rings 0
Rotatable Bonds 17
Van der Waals Molecular Volume 352.20
Topological Polar Surface Area 26.30
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 2
logP 6.42
Molar Refractivity 91.56

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Created at
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Updated at
19th Feb 2025