Indican

Structure Molecule image
Relationships Total Number of functionally related protein(s) : 263
Total Number of Articles : 255
PubChem 2733789
Molecular Formula

C14H23NO9

SMILES

C1=CC=C2C(=C1)C(=CN2)O[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O)O)O.O.O.O

InChI

InChI=1S/C14H17NO6.3H2O/c16-6-10-11(17)12(18)13(19)14(21-10)20-9-5-15-8-4-2-1-3-7(8)9;;;/h1-5,10-19H,6H2;3*1H2/t10-,11-,12+,13-,14-;;;/m1.../s1

synonyms
  • 1328-73-0
  • (2R,3S,4S,5R,6S)-2-(hydroxymethyl)-6-(1H-indol-3-yloxy)oxane-3,4,5-triol;trihydrate
  • INDICAN
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Properties
Property Value
MW 349.33 g/mol
HBD 8
HBA 9
Rotatable Bond Count 3
Exact Mass 349.13728131 g/mol
Monoisotopic Mass 349.13728131 g/mol
Heavy Atom Count 24
Isotope Atom Count 0
Atom Stereo Count 5
Covalent Unit Count 4
Complexity 356
xlogp None
Topological Polar Surface Area 118