Structure Database (LMSD)

Common Name
18Z-heptacosenoic acid
Systematic Name
18Z-heptacosenoic acid
Synonyms
  • 18-heptacosenoic acid, (18Z)-
LM ID
LMFA01031112
Formula
Exact Mass
Calculate m/z
408.39673
Sum Composition
Status
Active

Classification

Reactions

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Reactions graph legend

String Representations

InChiKey (Click to copy)
FFEYYWMFTZHUNB-KTKRTIGZSA-N
InChi (Click to copy)
InChI=1S/C27H52O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27(28)29/h9-10H,2-8,11-26H2,1H3,(H,28,29)/b10-9-
SMILES (Click to copy)
C(CCCCCCCCCCCCCCCC/C=C\CCCCCCCC)(=O)O

Other Databases

PubChem CID
PlantFA ID

Calculated Physicochemical Properties

Heavy Atoms 29
Rings 0
Aromatic Rings 0
Rotatable Bonds 24
Van der Waals Molecular Volume 487.96
Topological Polar Surface Area 37.3
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 2
logP 9.62
Molar Refractivity 128.64

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Created at
-
Updated at
25th Apr 2022