Structure Database (LMSD)

O OH O N H O
Common Name
N-formylmaleamic acid
Systematic Name
(2Z)-4-formamido-4-oxobut-2-enoic acid
Synonyms
  • (Z)-4-formamido-4-oxobut-2-enoic acid
LM ID
LMFA08020194
Formula
C5H5NO4
Exact Mass
Calculate m/z
143.021859
Sum Composition
NA 5:3;O3
Status
Active
Show lipids differing only in stereochemistry/bond geometry

Main

Classification

Category
Main Class
Sub Class
Fatty Acyls [FA]
Fatty amides [FA08]
N-acyl amines [FA0802]
Fatty Acids and Conjugates [FA01]
Unsaturated fatty acids [FA0103]

String Representations

InChiKey (Click to copy)
HSKSAKBZUITULZ-UPHRSURJSA-N
InChi (Click to copy)
InChI=1S/C5H5NO4/c7-3-6-4(8)1-2-5(9)10/h1-3H,(H,9,10)(H,6,7,8)/b2-1-
SMILES (Click to copy)
C(=O)(NC=O)/C=C\C(=O)O

References

Other Databases

KEGG ID
C18232
CHEBI ID
59930
PubChem CID
25188420
PDB ID
D6O

Calculated Physicochemical Properties

Heavy Atoms 10
Rings 0
Aromatic Rings 0
Rotatable Bonds 2
Van der Waals Molecular Volume 130.66
Topological Polar Surface Area 83.47
Hydrogen Bond Donors 2
Hydrogen Bond Acceptors 4
logP -1.10
Molar Refractivity 30.98

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Created at
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Updated at
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