Structure Database (LMSD)
Common Name
Parcoblattalactone
Systematic Name
3Z,10Z-dodecadienoic acid 1,12-lactone
Synonyms
- 3Z,10Z-dodecadien-12-olide
3D model of Parcoblattalactone
Please note: Where there are chiral atoms but the stereochemistry is undefined, the 3D model takes an arbitrary conformation
Main
Classification
Category
Main Class
Sub Class
String Representations
InChiKey (Click to copy)
HMDULPMCUXCQQR-VRHVFUOLSA-N
InChi (Click to copy)
InChI=1S/C12H18O2/c13-12-10-8-6-4-2-1-3-5-7-9-11-14-12/h6-9H,1-5,10-11H2/b8-6-,9-7-
SMILES (Click to copy)
O=C1CC=CCCCCCC=CCO1
References
Taxonomy Information
Curated from
NCBI taxonomy class
Reference
Parcoblatta lata
(#152182)
Insecta
(#50557)
Unusual macrocyclic lactone sex pheromone of Parcoblatta lata, a primary food source of the endangered red-cockaded woodpecker.,
Proc Natl Acad Sci U S A, 2012
Proc Natl Acad Sci U S A, 2012
Pubmed ID:
22184232
Other Databases
PubChem CID
Calculated Physicochemical Properties
Heavy Atoms
14
Rings
1
Aromatic Rings
0
Rotatable Bonds
0
Van der Waals Molecular Volume
213.46
Topological Polar Surface Area
28.37
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
2
logP
3.28
Molar Refractivity
57.43
Admin
Created at
-
Updated at
-