heme
C34H32FeN4O4
Molecular FormulaC34H32FeN4O4
Molecular Weight616.5 g/mol
Exact Mass616.177291
SMILES[H+].[H+].CC1=C(C2=CC3=NC(=CC4=C(C(=C([N-]4)C=C5C(=C(C(=N5)C=C1[N-]2)C=C)C)C=C)C)C(=C3CCC(=O)[O-])C)CCC(=O)[O-].[Fe+2]
InChIKeyKABFMIBPWCXCRK-UHFFFAOYSA-L
XLogPundefined
TPSA107 Ų
Complexity1570
H-Bond Donors2
H-Bond Acceptors8
Rotatable Bonds6
Charge0
PubChem CID162640511
Also Known As
hemeFerroheme14875-96-8HY-111914ACS-0104076