Catalog Number:
AG008RMW
Chemical Name:
Co(iii) protoporphyrin ix chloride
CAS Number:
102601-60-5
Molecular Formula:
C34H32ClCoN4O4
Molecular Weight:
655.0285
MDL Number:
MFCD00216774
IUPAC Name:
3-[18-(2-carboxyethyl)-7,12-bis(ethenyl)-3,8,13,17-tetramethylporphyrin-21,23-diid-2-yl]propanoic acid;chlorocobalt(2+)
InChI:
InChI=1S/C34H34N4O4.ClH.Co/c1-7-21-17(3)25-13-26-19(5)23(9-11-33(39)40)31(37-26)16-32-24(10-12-34(41)42)20(6)28(38-32)15-30-22(8-2)18(4)27(36-30)14-29(21)35-25;;/h7-8,13-16H,1-2,9-12H2,3-6H3,(H4,35,36,37,38,39,40,41,42);1H;/q;;+3/p-3
InChI Key:
WWNXKQFLDNSNDN-UHFFFAOYSA-K
SMILES:
C=CC1=C(C)C2=N/C/1=C\c1c(C)c(c3n1[Co](n1/c(=C\2)/c(C)c(/c/1=C/C1=N/C(=C\3)/C(=C1CCC(=O)O)C)CCC(=O)O)Cl)C=C
