brazilin

Structure Molecule image
Relationships Total Number of functionally related protein(s) : 29
Total Number of Articles : 17
PubChem 36689482
Molecular Formula

C16H14O5

SMILES

C1C2=CC(=C(C=C2[C@@H]3[C@@]1(COC4=C3C=CC(=C4)O)O)O)O

InChI

InChI=1S/C16H14O5/c17-9-1-2-10-14(4-9)21-7-16(20)6-8-3-12(18)13(19)5-11(8)15(10)16/h1-5,15,17-20H,6-7H2/t15-,16-/m1/s1

synonyms
  • Brazilin
  • 474-07-7
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Properties
Property Value
MW 286.28 g/mol
HBD 4
HBA 5
Rotatable Bond Count 0
Exact Mass 286.08412354 g/mol
Monoisotopic Mass 286.08412354 g/mol
Heavy Atom Count 21
Isotope Atom Count 0
Atom Stereo Count 2
Covalent Unit Count 1
Complexity 416
xlogp 1.5
Topological Polar Surface Area 90.2