Structure database (LMSD)

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LM IDLMFA01100035
Common Name6-amino-hexanoic acid (W)
Systematic Name6-amino-hexanoic acid
Synonyms6-Aminohexanoic acid
Exact Mass
131.0946 (neutral)    Calculate m/z:
FormulaC6H13NO2
CategoryFatty Acyls [FA]
Main ClassFatty Acids and Conjugates [FA01]
Sub ClassAmino fatty acids [FA0110]
PubChem CID564
KEGG IDC02378
HMDB IDHMDB0001901
CHEBI ID16586
CAYMAN ID23724
InChIKeySLXKOJJOQWFEFD-UHFFFAOYSA-N  Show lipids differing only in stereochemistry/bond geometry
InChI
InChI=1S/C6H13NO2/c7-5-3-1-2-4-6(8)9/h1-5,7H2,(H,8,9)
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SMILES
C(CCCN)CC(=O)O
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MS SpectraView MoNA MS spectra     
StatusActive
Calculated physicochemical properties (?):
 Heavy Atoms9Rings0Aromatic Rings0Rotatable Bonds5
 van der Waals
Molecular Volume
138.30Topological Polar
Surface Area
63.32Hydrogen
Bond Donors
2Hydrogen
Bond Acceptors
2
 logP0.87Molar
Refractivity
35.65