Structure Database (LMSD)

Common Name
7Z-palmitoleic acid
Systematic Name
7Z-hexadecenoic acid
Synonyms
  • C16:1n-9
LM ID
LMFA01030055
Status
Active
Exact Mass
Calculate m/z
254.22458
Formula
Abbrev



Download as...
MDLMOL SDF CSV TSV
MDLMOL files can be opened in various drawing programs. In ChemDraw, open as filetype "MDL Molfile".

Main

Classification

String Representations

InChiKey (Click to copy)
PJHOFUXBXJNUAC-KTKRTIGZSA-N
InChi (Click to copy)
InChI=1S/C16H30O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16(17)18/h9-10H,2-8,11-15H2,1H3,(H,17,18)/b10-9-
SMILES (Click to copy)
C(=C/CCCCCCCC)/CCCCCC(=O)O

References

Comments
https://www.caymanchem.com/product/10007290

Other Databases

HMDB ID
CHEBI ID
PubChem CID
Cayman ID

Calculated Physicochemical Properties

Heavy Atoms 18
Rings 0
Aromatic Rings 0
Rotatable Bonds 13
Van der Waals Molecular Volume 297.66
Topological Polar Surface Area 37.30
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 2
logP 5.33
Molar Refractivity 77.85

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Updated at
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