precorrin-3B(6-)

Compound Identifiers & Properties

PubChem CID

139031055

SMILES

C[C@@]12CC(=O)O[C@@]13[C@@](C4=C(C(=C(N4)CC5=C(C(=C(N5)/C=C\6/[C@H]([C@](C(=CC(=N3)[C@H]2CCC(=O)[O-])N6)(C)CC(=O)O)CCC(=O)[O-])CC(=O)[O-])CCC(=O)[O-])CCC(=O)[O-])CC(=O)[O-])(C)O

Canonical SMILES

C[C@]1(O)c2[nH]c(c(CCC(=O)[O-])c2CC(=O)[O-])Cc2[nH]c(c(CC(=O)[O-])c2CCC(=O)[O-])/C=C2\NC(=CC3=N[C@]14OC(=O)C[C@@]4(C)[C@@H]3CCC(=O)[O-])[C@@](C)(CC(=O)O)[C@@H]2CCC(=O)[O-]