Structure Database (LMSD)
Common Name
2-amino-4-oxo-pentanoic acid
Systematic Name
2-amino-4-oxo-pentanoic acid
Synonyms
- 2-Amino-4-oxopentanoic acid
No other lipid differing only in stereochemistry/bond geometry found
3D model of 2-amino-4-oxo-pentanoic acid
Please note: Where there are chiral atoms but the stereochemistry is undefined, the 3D model takes an arbitrary conformation
Classification
Category
Main Class
Sub Class
String Representations
InChiKey (Click to copy)
QUCHWTCTBHQQDU-BYPYZUCNSA-N
InChi (Click to copy)
InChI=1S/C5H9NO3/c1-3(7)2-4(6)5(8)9/h4H,2,6H2,1H3,(H,8,9)/t4-/m0/s1
SMILES (Click to copy)
OC(=O)[C@@H](N)CC(=O)C
Other Databases
Calculated Physicochemical Properties
Heavy Atoms
9
Rings
0
Aromatic Rings
0
Rotatable Bonds
3
Van der Waals Molecular Volume
127.15
Topological Polar Surface Area
80.39
Hydrogen Bond Donors
2
Hydrogen Bond Acceptors
3
logP
-0.34
Molar Refractivity
31.42
Admin
Created at
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Updated at
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