Structure Database (LMSD)
Common Name
7-hydroxy-10E,16-heptadecadien-8-ynoic acid
Systematic Name
7-hydroxy-10E,16-heptadecadien-8-ynoic acid
Synonyms
- Acetylenic acids
- 10,16-Heptadecadien-8-ynoic acid, 7-hydroxy, (E)-
No other lipid differing only in stereochemistry/bond geometry found
3D model of 7-hydroxy-10E,16-heptadecadien-8-ynoic 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)
SKEXYIDHVDOQQP-VOTSOKGWSA-N
InChi (Click to copy)
InChI=1S/C17H26O3/c1-2-3-4-5-6-7-8-10-13-16(18)14-11-9-12-15-17(19)20/h2,6-7,16,18H,1,3-5,8-9,11-12,14-15H2,(H,19,20)/b7-6+
SMILES (Click to copy)
C(CCCCCC(O)C#CC/C=C/CCCC=C)(=O)O
Other Databases
Calculated Physicochemical Properties
Heavy Atoms
20
Rings
0
Aromatic Rings
0
Rotatable Bonds
11
Van der Waals Molecular Volume
315.83
Topological Polar Surface Area
57.53
Hydrogen Bond Donors
2
Hydrogen Bond Acceptors
3
logP
3.97
Molar Refractivity
82.82
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Created at
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Updated at
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