Structure Database (LMSD)

Common Name
8Z-Dihydromatricaria acid
Systematic Name
8Z-Decene-4,6-diynoic acid
Synonyms
  • DHMA
  • Dihydromatricaria acid
LM ID
LMFA01030783
Formula
C10H10O2
Exact Mass
Calculate m/z
162.06808
Sum Composition
FA 10:5
Status
Active
Show lipids differing only in stereochemistry/bond geometry

Classification

Category
Main Class
Sub Class
Fatty Acyls [FA]
Fatty Acids and Conjugates [FA01]
Unsaturated fatty acids [FA0103]

Reactions

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ⓘ Reactions are shown if the E.C. number of the enzyme catalysing it is annotated in the UniProt database for a species belonging to the selected taxonomic class.
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Reactions graph legend

References

Taxonomy Information

Curated from
NCBI taxonomy class
Reference
Chauliognathus marginatus (#2680216)
Insecta (#50557)
Dihydromatricaria acid: acetylenic acid secreted by soldier beetle.,
Science, 1968
Pubmed ID: 5647835

String Representations

InChiKey (Click to copy)
CKFUQXLAOJQWNI-IHWYPQMZSA-N
InChi (Click to copy)
InChI=1S/C10H10O2/c1-2-3-4-5-6-7-8-9-10(11)12/h2-3H,8-9H2,1H3,(H,11,12)/b3-2-
SMILES (Click to copy)
C(CCC#CC#C/C=C\C)(=O)O

Other Databases

CHEBI ID
186791
PubChem CID
44256496

Calculated Physicochemical Properties

Heavy Atoms 12
Rings 0
Aromatic Rings 0
Rotatable Bonds 2
Van der Waals Molecular Volume 183.30
Topological Polar Surface Area 37.30
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 2
logP 1.43
Molar Refractivity 47.24

Admin

Created at
-
Updated at
25th Apr 2022