Structure Information
Compound Identification
SMILES
[Ca++].[Ca++].[Ca++].OC(COC(=O)C1=CN=CC=C1)COP([O-])(=O)OC1C(O)C(O)C(OP([O-])([O-])=O)C(O)C1O
InChIKey
InChIKey=GNRMNNPQYCLKAQ-UHFFFAOYSA-K
Formula
C15H20Ca3NO15P2
Mass
636.497
Compound Identification
SMILES
[Ca++].[Ca++].[Ca++].OC(COC(=O)C1=CN=CC=C1)COP([O-])(=O)OC1C(O)C(O)C(OP([O-])([O-])=O)C(O)C1O
InChIKey
InChIKey=GNRMNNPQYCLKAQ-UHFFFAOYSA-K
Formula
C15H20Ca3NO15P2
Mass
636.497