LIPID MAPS

Structure Database (LMSD)

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Common Name

WE 28:0/28:0

Systematic Name

Octacosanyl octacosanoate

Synonyms

Octacosyl octacosanoate

LM ID

LMFA07011674

Formula

C₅₆H₁₁₂O₂

Exact Mass

Calculate m/z

816.866232

Sum Composition

WE 56:0

Status

Curated

Show lipids differing only in stereochemistry/bond geometry

Classification

Reactions

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References

Taxonomy Information

Curated from

NCBI taxonomy class

Reference

Bemisia argentifolii (#77855)

Insecta (#50557)

The composition of the cuticular lipids from nymphs and exuviae of the Silverleaf Whitefly, Bemisia argentifolii,
Comp Biochem Physiol B, 1999

DOI: 10.1016/S0305-0491(99)00117-0

String Representations

InChiKey (Click to copy)

HJVFAGBLJBBLJY-UHFFFAOYSA-N

InChi (Click to copy)

InChI=1S/C56H112O2/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-37-39-41-43-45-47-49-51-53-55-58-56(57)54-52-50-48-46-44-42-40-38-36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h3-55H2,1-2H3

SMILES (Click to copy)

C(CCCCCCCCCCCCCCCCCCCCCCCCCCC)(=O)OCCCCCCCCCCCCCCCCCCCCCCCCCCCC

Other Databases

PubChem CID

71369196

Calculated Physicochemical Properties

Heavy Atoms 58

Rings

Aromatic Rings

Rotatable Bonds 54

Van der Waals Molecular Volume 992.30

Topological Polar Surface Area 26.30

Hydrogen Bond Donors

Hydrogen Bond Acceptors 2

logP 21.14

Molar Refractivity 262.88

Admin

Created at

3rd Jun 2026

Updated at