Structure Database (LMSD)

Common Name
2-hydroxy palmitic acid
Systematic Name
2-hydroxy-hexadecanoic acid
Synonyms
LM ID
LMFA01050047
Status
Active
Exact Mass
Calculate m/z
272.235145
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)
JGHSBPIZNUXPLA-UHFFFAOYSA-N
InChi (Click to copy)
InChI=1S/C16H32O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15(17)16(18)19/h15,17H,2-14H2,1H3,(H,18,19)
SMILES (Click to copy)
C(CCCCCCCCCCCCC)C(O)C(=O)O

References

Other Databases

CHEBI ID
LIPIDBANK ID
PubChem CID
PlantFA ID
SwissLipids ID
Cayman ID

Calculated Physicochemical Properties

Heavy Atoms 19
Rings 0
Aromatic Rings 0
Rotatable Bonds 14
Van der Waals Molecular Volume 309.09
Topological Polar Surface Area 57.53
Hydrogen Bond Donors 2
Hydrogen Bond Acceptors 3
logP 4.81
Molar Refractivity 79.85

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Created at
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Updated at
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