Structure Database (LMSD)
Common Name
9,12,15-Octadecatrien-1-ol
Systematic Name
9,12,15-Octadecatrien-1-ol
Synonyms
No other lipid differing only in stereochemistry/bond geometry found
3D model of 9,12,15-Octadecatrien-1-ol
Please note: Where there are chiral atoms but the stereochemistry is undefined, the 3D model takes an arbitrary conformation
Main
Classification
String Representations
InChiKey (Click to copy)
IKYKEVDKGZYRMQ-IUQGRGSQSA-N
InChi (Click to copy)
InChI=1S/C18H32O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19/h3-4,6-7,9-10,19H,2,5,8,11-18H2,1H3/b4-3+,7-6+,10-9+
SMILES (Click to copy)
OCCCCCCCC/C=C/C/C=C/C/C=C/CC
References
Calculated Physicochemical Properties
Heavy Atoms
19
Rings
0
Aromatic Rings
0
Rotatable Bonds
13
Van der Waals Molecular Volume
320.83
Topological Polar Surface Area
20.23
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
1
logP
5.85
Molar Refractivity
86.84
Reactions
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Admin
Created at
-
Updated at
25th Apr 2022