heme C

Compound Identifiers & Properties

PubChem CID

91936966

SMILES

CC\1=C(/C/2=C/C3=C(C(=C([N-]3)/C=C\4/C(=C\S)/C(=C(\C)/S)/C(=C/C5=C(C(=C([N-]5)/C=C1\[N-]2)[C@H](C)S)C)/[N-]4)C)CCC(=O)O)CCC(=O)O.[Fe+4]

Canonical SMILES

C/C(S)=c1c2\[n-]c(c/1=C\S)=C\c1[n-]c(c(CCC(=O)O)c1C)/C=c1\[n-]/c(c(C)c1CCC(=O)O)=C\c1[n-]c(c(C)c1[C@H](C)S)/C=2.[Fe+4]