Structure Database (LMSD)

Common Name
(+)-mathuralure
Systematic Name
9R,10S-Epoxy-3Z,6Z-nonadecadiene
Synonyms
LM ID
LMFA12000294
Formula
C19H34O
Exact Mass
Calculate m/z
278.260966
Status
Curated
Show lipids differing only in stereochemistry/bond geometry

Classification

Category
Main Class
Sub Class
Fatty Acyls [FA]
Oxygenated hydrocarbons [FA12]

References

Comments
Pherobase Semiochemicals

Taxonomy Information

Curated from
NCBI taxonomy class
Reference
Lymantria mathura (#335468)
Insecta (#50557)
Sex Pheromone Components of Pink Gypsy Moth, Lymantria mathura,
Naturwissenschaften, 1999

String Representations

InChiKey (Click to copy)
CEWBAXULNPORDY-HXQMLSCISA-N
InChi (Click to copy)
InChI=1S/C19H34O/c1-3-5-7-9-11-13-15-17-19-18(20-19)16-14-12-10-8-6-4-2/h6,8,12,14,18-19H,3-5,7,9-11,13,15-17H2,1-2H3/b8-6-,14-12-/t18-,19+/m0/s1
SMILES (Click to copy)
CC/C=C\C/C=C\C[C@@H]1O[C@@H]1CCCCCCCCC

Other Databases

CHEBI ID
179586
PubChem CID
11196716

Calculated Physicochemical Properties

Heavy Atoms 20
Rings 1
Aromatic Rings 0
Rotatable Bonds 13
Van der Waals Molecular Volume 328.41
Topological Polar Surface Area 12.53
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 1
logP 6.77
Molar Refractivity 90.10

Admin

Created at
-
Updated at
19th Dec 2025