Structure Database (LMSD)
Systematic Name
3-Hydroxy-2,8-dimethyl-1,7-dioxaspiro[5.5]undecane
Synonyms
No other lipid differing only in stereochemistry/bond geometry found
3D model of
Please note: Where there are chiral atoms but the stereochemistry is undefined, the 3D model takes an arbitrary conformation
Classification
References
Comments
Pherobase Semiochemicals
String Representations
InChiKey (Click to copy)
FHLZKMYUVAGRFB-UHFFFAOYSA-N
InChi (Click to copy)
InChI=1S/C11H20O3/c1-8-4-3-6-11(13-8)7-5-10(12)9(2)14-11/h8-10,12H,3-7H2,1-2H3
SMILES (Click to copy)
O1C2(CCCC(C)O2)CCC(O)C1C
Other Databases
Calculated Physicochemical Properties
Heavy Atoms
14
Rings
2
Aromatic Rings
0
Rotatable Bonds
0
Van der Waals Molecular Volume
200.51
Topological Polar Surface Area
42.83
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
3
logP
2.98
Molar Refractivity
54.96
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Created at
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Updated at
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