Hydroxyapatite

ChemSpider ID: 14098
Molecular Formula: HCa₅O₁₃P₃
Average mass: 502.311401 Da
Monoisotopic mass: 501.675964 Da
Systematic name

Calcium hydroxide phosphate (5:1:3)
SMILES and InChIs

SMILES:

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

Std. InChI:

InChI=1S/5Ca.3H3O4P.H2O/c;;;;;3*1-5(2,3)4;/h;;;;;3*(H3,1,2,3,4);1H2/q5*+2;;;;/p-10 Copied

Std. InChIKey:

XYJRXVWERLGGKC-UHFFFAOYSA-D Copied
Cite this record
CSID:14098, http://www.chemspider.com/Chemical-Structure.14098.html (accessed 14:14, Jun 19, 2013) Copied

Names and Identifiers

Predicted data is generated using the ACD/Labs’ ACD/PhysChem Suite, for more information see their website.

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