Hem
Molecular Formula:
C34H34FeN4O4S
InChI: InChI=1/C34H36N4O4S.Fe/c1-7-21-16(2)26-14-31-34(20(6)43)19(5)27(38-31)12-24-17(3)22(8-10-32(39)40)29(36-24)15-30-23(9-11-33(41)42)18(4)25(37-30)13-28(21)35-26;/h7,12-15,20H,1,8-11H2,2-6H3,(H5,35,36,37,38,39,40,41,42,43);/q;+2/p-2/b24-12-,25-13-,26-14-,27-12-,28-13-,29-15-,30-15-,31-14-;/t20-;/m0./s1/fC34H34N4O4S.Fe/h39,41,43H;/q-2;m
InChIKey: InChIKey=CQXWSRJSQXAZPN-SAKWTURWDR
SMILES: CC1=C(C2=CC3=NC(=CC4=C(C(=C([N-]4)C=C5C(=C(C(=N5)C=C1[N-]2)C(C)S)C)C)CCC(=O)O)C(=C3C)CCC(=O)O)C=C.[Fe+2]
Names:
Hem
Registries:
PubChem CID 4369255
PubChem ID 11532154
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