octacalcium phosphate pentahydrate

Systemtic Name: octacalcium phosphate pentahydrate Openeye Name: octacalcium phosphate pentahydrate CAS Name: octacalcium phosphate pentahydrate IUPAC Name: octacalcium phosphate pentahydrate Traditional Name: octacalcium phosphate pentahydrate Formula: Ca8H10O9P+13 MolecularWeight: 505.671761

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Descriptors Computed from Structure

Canonical SMILES:

O.O.O.O.O.[O-]P(=O)([O-])[O-].[Ca+2].[Ca+2].[Ca+2].[Ca+2].[Ca+2].[Ca+2].[Ca+2].[Ca+2]

Isomeric SMILES

O.O.O.O.O.[O-]P(=O)([O-])[O-].[Ca+2].[Ca+2].[Ca+2].[Ca+2].[Ca+2].[Ca+2].[Ca+2].[Ca+2]

InChI

InChI=1S/8Ca.H3O4P.5H2O/c;;;;;;;;1-5(2,3)4;;;;;/h;;;;;;;;(H3,1,2,3,4);5*1H2/q8*+2;;;;;;/p-3