Bilirubin

Structure Molecule image
Relationships Total Number of functionally related protein(s) : 1080
Total Number of Articles : 2936
PubChem 5280352
Molecular Formula

C33H36N4O6

SMILES

CC1=C(NC(=C1CCC(=O)O)CC2=C(C(=C(N2)/C=C\3/C(=C(C(=O)N3)C)C=C)C)CCC(=O)O)/C=C\4/C(=C(C(=O)N4)C=C)C

InChI

InChI=1S/C33H36N4O6/c1-7-20-19(6)32(42)37-27(20)14-25-18(5)23(10-12-31(40)41)29(35-25)15-28-22(9-11-30(38)39)17(4)24(34-28)13-26-16(3)21(8-2)33(43)36-26/h7-8,13-14,34-35H,1-2,9-12,15H2,3-6H3,(H,36,43)(H,37,42)(H,38,39)(H,40,41)/b26-13-,27-14-

synonyms
  • bilirubin
  • 635-65-4
  • Hematoidin
Click to show/hide the synonyms
Properties
Property Value
MW 584.7 g/mol
HBD 6
HBA 6
Rotatable Bond Count 12
Exact Mass 584.26348488 g/mol
Monoisotopic Mass 584.26348488 g/mol
Heavy Atom Count 43
Isotope Atom Count 0
Atom Stereo Count 0
Covalent Unit Count 1
Complexity 1340
xlogp 2.9
Topological Polar Surface Area 164