Structure database (LMSD)

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LM IDLMFA01050071
Common Name2-hydroxy-nonadecanoic acid
Systematic Name2-hydroxy-nonadecanoic acid
Synonyms-
Exact Mass
314.2821 (neutral)    Calculate m/z:
FormulaC19H38O3
CategoryFatty Acyls [FA]
Main ClassFatty Acids and Conjugates [FA01]
Sub ClassHydroxy fatty acids [FA0105]
LIPIDBANK IDDFA0337
PubChem CID5282916
InChIKeyPYNCEZHRMYECCB-UHFFFAOYSA-N  Show lipids differing only in stereochemistry/bond geometry
InChI
InChI=1S/C19H38O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(20)19(21)22/h18,20H,2-17H2,1H3,(H,21,22)
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SMILES
C(CCCCCCCCCCCCCCCC)C(O)C(=O)O
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StatusActive
Calculated physicochemical properties (?):
 Heavy Atoms22Rings0Aromatic Rings0Rotatable Bonds17
 van der Waals
Molecular Volume
360.99Topological Polar
Surface Area
57.53Hydrogen
Bond Donors
2Hydrogen
Bond Acceptors
3
 logP5.98Molar
Refractivity
93.70