Structure Database (LMSD)

Common Name
2E,6Z-decadienoic acid
Systematic Name
2E,6Z-decadienoic acid
Synonyms
  • trans-2, cis-6-decadienoic acid
  • C10:2n-4,8
LM ID
LMFA01030106
Formula
Exact Mass
Calculate m/z
168.11503
Sum Composition
Status
Active

Classification

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

String Representations

InChiKey (Click to copy)
GTVXSZWUQLCDFX-FTGFODROSA-N
InChi (Click to copy)
InChI=1S/C10H16O2/c1-2-3-4-5-6-7-8-9-10(11)12/h4-5,8-9H,2-3,6-7H2,1H3,(H,11,12)/b5-4-,9-8+
SMILES (Click to copy)
C(=C/CCC)/CC/C=C/C(=O)O

Other Databases

CHEBI ID
LIPIDBANK ID
DFA0145
PubChem CID

Calculated Physicochemical Properties

Heavy Atoms 12
Rings 0
Aromatic Rings 0
Rotatable Bonds 6
Van der Waals Molecular Volume 191.22
Topological Polar Surface Area 37.30
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 2
logP 2.76
Molar Refractivity 50.06

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Created at
-
Updated at
25th Apr 2022