Phytin

Compound Identifiers & Properties

CAS

3615-82-5

PubChem CID

126963567

SMILES

C1(C(C(C(C(C1OP(=O)([O-])[O-])OP(=O)([O-])[O-])OP(=O)([O-])[O-])OP(=O)([O-])[O-])OP(=O)([O-])[O-])OP(=O)([O-])[O-].[Mg+2].[Mg+2].[Mg+2].[Mg+2].[Mg+2].[Mg+2].[Ca].[Ca].[Ca].[Ca].[Ca].[Ca]

Canonical SMILES

O=P([O-])([O-])OC1C(OP(=O)([O-])[O-])C(OP(=O)([O-])[O-])C(OP(=O)([O-])[O-])C(OP(=O)([O-])[O-])C1OP(=O)([O-])[O-].[Ca].[Ca].[Ca].[Ca].[Ca].[Ca].[Mg+2].[Mg+2].[Mg+2].[Mg+2].[Mg+2].[Mg+2]