Structure Database (LMSD)
Common Name
15-hydroxy-heneicosanoic acid
Systematic Name
15-hydroxy-heneicosanoic acid
Synonyms
3D model of 15-hydroxy-heneicosanoic acid
Please note: Where there are chiral atoms but the stereochemistry is undefined, the 3D model takes an arbitrary conformation
Classification
Category
Main Class
Sub Class
String Representations
InChiKey (Click to copy)
QOHOPIAGXYYWBQ-UHFFFAOYSA-N
InChi (Click to copy)
InChI=1S/C21H42O3/c1-2-3-4-14-17-20(22)18-15-12-10-8-6-5-7-9-11-13-16-19-21(23)24/h20,22H,2-19H2,1H3,(H,23,24)
SMILES (Click to copy)
C(CCCCCCCCCCCCCC(O)CCCCCC)(=O)O
Other Databases
Calculated Physicochemical Properties
Heavy Atoms
24
Rings
0
Aromatic Rings
0
Rotatable Bonds
19
Van der Waals Molecular Volume
395.59
Topological Polar Surface Area
57.53
Hydrogen Bond Donors
2
Hydrogen Bond Acceptors
3
logP
6.76
Molar Refractivity
102.93
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Created at
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Updated at
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