3-(2-carboxyindol-3-yl)propionic acid

Structure Molecule image
Relationships Total Number of functionally related protein(s) : 18
Total Number of Articles : 18
PubChem 169313
Molecular Formula

C12H11NO4

SMILES

C1=CC=C2C(=C1)C(=C(N2)C(=O)O)CCC(=O)O

InChI

InChI=1S/C12H11NO4/c14-10(15)6-5-8-7-3-1-2-4-9(7)13-11(8)12(16)17/h1-4,13H,5-6H2,(H,14,15)(H,16,17)

synonyms
  • 31529-28-9
  • 1H-Indole-3-propanoic acid, 2-carboxy-
  • 3-(2-Carboxyindol-3-yl)propionic acid
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Properties
Property Value
MW 233.22 g/mol
HBD 3
HBA 4
Rotatable Bond Count 4
Exact Mass 233.06880783 g/mol
Monoisotopic Mass 233.06880783 g/mol
Heavy Atom Count 17
Isotope Atom Count 0
Atom Stereo Count 0
Covalent Unit Count 1
Complexity 318
xlogp 1.7
Topological Polar Surface Area 90.4