temoporfin

Structure Molecule image
Relationships Total Number of functionally related protein(s) : 33
Total Number of Articles : 29
PubChem 60751
Molecular Formula

C44H32N4O4

SMILES

C1CC2=NC1=C(C3=CC=C(N3)C(=C4C=CC(=N4)C(=C5C=CC(=C2C6=CC(=CC=C6)O)N5)C7=CC(=CC=C7)O)C8=CC(=CC=C8)O)C9=CC(=CC=C9)O

InChI

InChI=1S/C44H32N4O4/c49-29-9-1-5-25(21-29)41-33-13-15-35(45-33)42(26-6-2-10-30(50)22-26)37-17-19-39(47-37)44(28-8-4-12-32(52)24-28)40-20-18-38(48-40)43(36-16-14-34(41)46-36)27-7-3-11-31(51)23-27/h1-17,19,21-24,46-47,49-52H,18,20H2

synonyms
  • TEMOPORFIN
  • 122341-38-2
  • Foscan
Click to show/hide the synonyms
Properties
Property Value
MW 680.7 g/mol
HBD 6
HBA 6
Rotatable Bond Count 4
Exact Mass 680.24235551 g/mol
Monoisotopic Mass 680.24235551 g/mol
Heavy Atom Count 52
Isotope Atom Count 0
Atom Stereo Count 0
Covalent Unit Count 1
Complexity 1090
xlogp 8.8
Topological Polar Surface Area 138