hypericin

Structure Molecule image
Relationships Total Number of functionally related protein(s) : 184
Total Number of Articles : 191
PubChem 3663
Molecular Formula

C30H16O8

SMILES

CC1=CC(=O)C2=C(C3=C(C=C(C4=C3C5=C2C1=C6C(=CC(=O)C7=C(C8=C(C=C(C4=C8C5=C67)O)O)O)C)O)O)O

InChI

InChI=1S/C30H16O8/c1-7-3-9(31)19-23-15(7)16-8(2)4-10(32)20-24(16)28-26-18(12(34)6-14(36)22(26)30(20)38)17-11(33)5-13(35)21(29(19)37)25(17)27(23)28/h3-6,33-38H,1-2H3

synonyms
  • hypericin
  • 548-04-9
  • Hypericum red
Click to show/hide the synonyms
Properties
Property Value
MW 504.4 g/mol
HBD 6
HBA 8
Rotatable Bond Count 0
Exact Mass 504.08451746 g/mol
Monoisotopic Mass 504.08451746 g/mol
Heavy Atom Count 38
Isotope Atom Count 0
Atom Stereo Count 0
Covalent Unit Count 1
Complexity 1090
xlogp 5.7
Topological Polar Surface Area 156