Structure database (LMSD)

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LM IDLMFA01050045
Common Name2-hydroxy-pentadecanoic acid
Systematic Name2-hydroxy-pentadecanoic acid
Synonyms-
Exact Mass
258.2195 (neutral)    Calculate m/z:
FormulaC15H30O3
CategoryFatty Acyls [FA]
Main ClassFatty Acids and Conjugates [FA01]
Sub ClassHydroxy fatty acids [FA0105]
LIPIDBANK IDDFA0311
PubChem CID5282903
InChIKeyNKASEPJANRVKDD-UHFFFAOYSA-N  Show lipids differing only in stereochemistry/bond geometry
InChI
InChI=1S/C15H30O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14(16)15(17)18/h14,16H,2-13H2,1H3,(H,17,18)
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SMILES
C(CCCCCCCCCCCC)C(O)C(=O)O
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StatusActive
Calculated physicochemical properties (?):
 Heavy Atoms18Rings0Aromatic Rings0Rotatable Bonds13
 van der Waals
Molecular Volume
291.79Topological Polar
Surface Area
57.53Hydrogen
Bond Donors
2Hydrogen
Bond Acceptors
3
 logP4.42Molar
Refractivity
75.23