Structure database (LMSD)

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LM IDLMFA01100007
Common Name2-amino-tetradecanoic acid
Systematic Name2-amino-tetradecanoic acid
Synonyms-
Exact Mass
243.2198 (neutral)    Calculate m/z:
FormulaC14H29NO2
CategoryFatty Acyls [FA]
Main ClassFatty Acids and Conjugates [FA01]
Sub ClassAmino fatty acids [FA0110]
LIPIDAT ID2328
PubChem CID252477
InChIKeyBVXKPGXJOLWHFI-UHFFFAOYSA-N  Show lipids differing only in stereochemistry/bond geometry
InChI
InChI=1S/C14H29NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13(15)14(16)17/h13H,2-12,15H2,1H3,(H,16,17)
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SMILES
C(C(N)CCCCCCCCCCCC)(=O)O
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StatusActive
Calculated physicochemical properties (?):
 Heavy Atoms17Rings0Aromatic Rings0Rotatable Bonds12
 van der Waals
Molecular Volume
276.70Topological Polar
Surface Area
63.32Hydrogen
Bond Donors
2Hydrogen
Bond Acceptors
2
 logP4.00Molar
Refractivity
72.58