4-Hydroxyestrone-2-glutathione-15N3

Compound Identifiers & Properties

PubChem CID

169441569

SMILES

C[C@]12CC[C@H]3[C@H]([C@@H]1CCC2=O)CCC4=C(C(=C(C=C34)SC[C@@H](C(=O)[15NH]CC(=O)O)[15NH]C(=O)CC[C@@H](C(=O)O)[15NH2])O)O

Canonical SMILES

C[C@]12CC[C@@H]3c4cc(SC[C@H]([15NH]C(=O)CC[C@H]([15NH2])C(=O)O)C(=O)[15NH]CC(=O)O)c(O)c(O)c4CC[C@H]3[C@@H]1CCC2=O