atranorin

Structure Molecule image
Relationships Total Number of functionally related protein(s) : 23
Total Number of Articles : 7
PubChem 68066
Molecular Formula

C19H18O8

SMILES

CC1=CC(=C(C(=C1C(=O)OC2=C(C(=C(C(=C2)C)C(=O)OC)O)C)O)C=O)O

InChI

InChI=1S/C19H18O8/c1-8-5-12(21)11(7-20)17(23)15(8)19(25)27-13-6-9(2)14(18(24)26-4)16(22)10(13)3/h5-7,21-23H,1-4H3

synonyms
  • Atranorin
  • 479-20-9
  • Atranoric acid
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Properties
Property Value
MW 374.3 g/mol
HBD 3
HBA 8
Rotatable Bond Count 6
Exact Mass 374.10016753 g/mol
Monoisotopic Mass 374.10016753 g/mol
Heavy Atom Count 27
Isotope Atom Count 0
Atom Stereo Count 0
Covalent Unit Count 1
Complexity 564
xlogp 4.3
Topological Polar Surface Area 130