Structure Database (LMSD)

O OH
Common Name
7Z-heptadecenoic acid
Systematic Name
7Z-heptadecenoic acid
Synonyms
  • C17:1n-10
LM ID
LMFA01030286
Formula
Exact Mass
Calculate m/z
268.24023
Sum Composition
Status
Active

Main

Classification

String Representations

InChiKey (Click to copy)
FJMPAYNWWWCODA-KHPPLWFESA-N
InChi (Click to copy)
InChI=1S/C17H32O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17(18)19/h10-11H,2-9,12-16H2,1H3,(H,18,19)/b11-10-
SMILES (Click to copy)
C(CCCCC/C=C\CCCCCCCCC)(=O)O

References

Other Databases

LIPIDAT ID
4183
PubChem CID

Calculated Physicochemical Properties

Heavy Atoms 19
Rings 0
Aromatic Rings 0
Rotatable Bonds 14
Van der Waals Molecular Volume 314.96
Topological Polar Surface Area 37.30
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 2
logP 5.72
Molar Refractivity 82.47

Reactions

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Reactions graph legend

Admin

Created at
-
Updated at
25th Apr 2022