Structure database (LMSD)

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LM IDLMFA05000019
Common NamePanaxynol
Systematic Name1,9Z-heptadecadien-4,6-diyn-3-ol
Synonymsheptadeca-1,9Z-dien-4,6-diyn-3-ol
Exact Mass
244.1827 (neutral)    Calculate m/z:
FormulaC17H24O
CategoryFatty Acyls [FA]
Main ClassFatty alcohols [FA05]
Sub Class-
PubChem CID5283273
InChIKeyUGJAEDFOKNAMQD-KHPPLWFESA-N  Show lipids differing only in stereochemistry/bond geometry
InChIInChI=1S/C17H24O/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17(18)4-2/h4,10-11,17-18H,2
-3,5-9,12H2,1H3/b11-10-
SMILESC(C#CC#CC/C=C\CCCCCCC)(O)C=C
StatusActive
Calculated physicochemical properties (?):
 Heavy Atoms18Rings0Aromatic Rings0Rotatable Bonds8
 van der Waals
Molecular Volume
295.61Topological Polar
Surface Area
20.23Hydrogen
Bond Donors
1Hydrogen
Bond Acceptors
1
 logP4.13Molar
Refractivity
79.40