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calcium octane phosphate

calcium octane phosphate

Systemtic Name:calcium octane phosphate
Openeye Name:calcium octane phosphate
CAS Name:calcium octane phosphate
IUPAC Name:calcium octane phosphate
Traditional Name:calcium octane phosphate
Formula: C16H34CaO4P-3
MolecularWeight: 361.490521
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC[CH2-].CCCCCCC[CH2-].[O-]P(=O)([O-])[O-].[Ca+2]


Isomeric SMILES

CCCCCCC[CH2-].CCCCCCC[CH2-].[O-]P(=O)([O-])[O-].[Ca+2]


InChI

InChI=1S/2C8H17.Ca.H3O4P/c2*1-3-5-7-8-6-4-2;;1-5(2,3)4/h2*1,3-8H2,2H3;;(H3,1,2,3,4)/q2*-1;+2;/p-3


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