Structure Database (LMSD)
Common Name
15-hydroxy-9Z,12Z-pentadecadienoic acid
Systematic Name
15-hydroxy-9Z,12Z-pentadecadienoic acid
Synonyms
3D model of 15-hydroxy-9Z,12Z-pentadecadienoic acid
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)
ONMBZNVMNBTBBN-VBFFHFTGSA-N
InChi (Click to copy)
InChI=1S/C15H26O3/c16-14-12-10-8-6-4-2-1-3-5-7-9-11-13-15(17)18/h2,4,8,10,16H,1,3,5-7,9,11-14H2,(H,17,18)/b4-2-,10-8-
SMILES (Click to copy)
C(CCCCCCC/C=C\C/C=C\CCO)(=O)O
References
Calculated Physicochemical Properties
Heavy Atoms
18
Rings
Aromatic Rings
Rotatable Bonds
12
Van der Waals Molecular Volume
286.51
Topological Polar Surface Area
57.53
Hydrogen Bond Donors
2
Hydrogen Bond Acceptors
3
logP
3.97
Molar Refractivity
75.04
Admin
Created at
4th Jun 2024
Updated at
4th Jun 2024