Structure Database (LMSD)

Common Name
4,5-decadien-7,9-diyn-1-ol
Systematic Name
4,5(R)-octadien-7,9-diyn-1-ol
Synonyms
LM ID
LMFA05000708
Formula
C10H10O
Exact Mass
Calculate m/z
146.073165
Sum Composition
FOH 10:6
Status
Curated
Show lipids differing only in stereochemistry/bond geometry

Classification

Category
Main Class
Sub Class
Fatty Acyls [FA]
Fatty alcohols [FA05]

String Representations

InChiKey (Click to copy)
JAZZIHJCFPWOSV-LURJTMIESA-N
InChi (Click to copy)
InChI=1S/C10H10O/c1-2-3-4-5-6-7-8-9-10-11/h1,5,7,11H,8-10H2/t6-/m0/s1
SMILES (Click to copy)
C(CC([H])=[C@]=C([H])C#CC#C)CO

Other Databases

PubChem CID
101408848

Calculated Physicochemical Properties

Heavy Atoms 11
Rings 0
Aromatic Rings 0
Rotatable Bonds 3
Van der Waals Molecular Volume 174.51
Topological Polar Surface Area 20.23
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 1
logP 1.39
Molar Refractivity 46.07

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Created at
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Updated at
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