Structure Database (LMSD)

Common Name
Geranylfarnesol
Systematic Name
3,7,11,15,19-Pentamethyleicosa-2E,6E,10E,14E,18-pentaen-1-ol
Synonyms
LM ID
LMFA05000218
Formula
C25H42O
Exact Mass
Calculate m/z
358.323566
Sum Composition
FOH 25:5
Status
Curated
Show lipids differing only in stereochemistry/bond geometry

Classification

Category
Main Class
Sub Class
Level 4 Class
Prenol Lipids [PR]
Isoprenoids [PR01]
C25 isoprenoids (sesterterpenes) [PR0105]
Acyclic sesterterpenoids [PR010501]

References

Comments
Pherobase

Taxonomy Information

Curated from
NCBI taxonomy class
Reference
Camponotus arminius (#604831)
Insecta (#50557)
Volatile chemicals in glands of the carpenter ant, Camponotus arminius,
S Afr J Zool, 1999

String Representations

InChiKey (Click to copy)
YHTCXUSSQJMLQD-GIXZANJISA-N
InChi (Click to copy)
InChI=1S/C25H42O/c1-21(2)11-7-12-22(3)13-8-14-23(4)15-9-16-24(5)17-10-18-25(6)19-20-26/h11,13,15,17,19,26H,7-10,12,14,16,18,20H2,1-6H3/b22-13+,23-15+,24-17+,25-19+
SMILES (Click to copy)
OC/C=C(\C)/CC/C=C(\C)/CC/C=C(\C)/CC/C=C(\C)/CC/C=C(\C)/C

Other Databases

CHEBI ID
167138
PubChem CID
6439529

Calculated Physicochemical Properties

Heavy Atoms 26
Rings 0
Aromatic Rings 0
Rotatable Bonds 13
Van der Waals Molecular Volume 436.65
Topological Polar Surface Area 20.23
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 1
logP 8.14
Molar Refractivity 118.97

Admin

Created at
-
Updated at
6th Dec 2024