Structure Database (LMSD)

Common Name
R-nostrenol
Systematic Name
6Z-Undecen-2R-ol
Synonyms
  • (R,Z)-Undec-6-en-2-ol
LM ID
LMFA05000511
Formula
C11H22O
Exact Mass
Calculate m/z
170.167065
Sum Composition
FOH 11:1
Status
Curated
Show lipids differing only in stereochemistry/bond geometry

Classification

Category
Main Class
Sub Class
Fatty Acyls [FA]
Fatty alcohols [FA05]

References

Comments
Pherobase Semiochemicals

Taxonomy Information

Curated from
NCBI taxonomy class
Reference
Myrmeleon bore (#1331307)
Insecta (#50557)
De Novo Asymmetric Synthesis of Avocadyne, Avocadene, and Avocadane Stereoisomers.,
J Org Chem, 2019
Pubmed ID: 31647231

String Representations

InChiKey (Click to copy)
URTNVXMNWNBRFL-JMEBYUIHSA-N
InChi (Click to copy)
InChI=1S/C11H22O/c1-3-4-5-6-7-8-9-10-11(2)12/h6-7,11-12H,3-5,8-10H2,1-2H3/b7-6-/t11-/m1/s1
SMILES (Click to copy)
C[C@@H](O)CCC/C=C\CCCC

Other Databases

CHEBI ID
186825
PubChem CID
11275269

Calculated Physicochemical Properties

Heavy Atoms 12
Rings 0
Aromatic Rings 0
Rotatable Bonds 7
Van der Waals Molecular Volume 205.01
Topological Polar Surface Area 20.23
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 1
logP 3.57
Molar Refractivity 54.71

Admin

Created at
-
Updated at
10th Nov 2021