Structure database (LMSD)

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LM IDLMFA01060171
Common Name2-amino-4-oxo-pentanoic acid
Systematic Name2-amino-4-oxo-pentanoic acid
Synonyms2-Amino-4-oxopentanoic acid
Exact Mass
131.0582 (neutral)    Calculate m/z:
FormulaC5H9NO3
CategoryFatty Acyls [FA]
Main ClassFatty Acids and Conjugates [FA01]
Sub ClassOxo fatty acids [FA0106]
Alternative ClassesAmino fatty acids[FA0110]
PubChem CID11029881
KEGG IDC03341
CHEBI ID15914
InChIKeyQUCHWTCTBHQQDU-BYPYZUCNSA-N  Show lipids differing only in stereochemistry/bond geometry
InChI
InChI=1S/C5H9NO3/c1-3(7)2-4(6)5(8)9/h4H,2,6H2,1H3,(H,8,9)/t4-/m0/s1
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SMILES
OC(=O)[C@@H](N)CC(=O)C
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StatusActive
Calculated physicochemical properties (?):
 Heavy Atoms9Rings0Aromatic Rings0Rotatable Bonds3
 van der Waals
Molecular Volume
127.15Topological Polar
Surface Area
80.39Hydrogen
Bond Donors
2Hydrogen
Bond Acceptors
3
 logP-0.34Molar
Refractivity
31.42