Magnesium aspartate tetrahydrate

C8H20MgN2O12CAS 7018-07-7360.56 g/mol

Open in Covalent MOL file
NH2O−OO−ONH2OOHOHOH2OH2OH2OH2OMg2+
Carboxylic acidPrimary amine

Properties

Molecular formula
C8H20MgN2O12
Molar mass
360.56 g/mol
Exact mass
360.0867 Da
logP
-3.16Crippen estimate
Polar surface area
163.6 Ų
H-bond donors / acceptors
3 / 3
Rotatable bonds
3
Stereocentres
S, Sin SMILES atom order

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless.

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Identifiers

CAS number
7018-07-7
SMILES
N[C@@H](CC([O-])=O)C([O-])=O.N[C@@H](CC(=O)O)C(=O)O.O.O.O.O.[Mg+2]
InChI

The InChI we hold for this record describes the parent acid and the metal separately rather than the salt above, so it is not shown here.

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Names and synonyms

3 names
  • L-Aspartic acid, magnesium salt, hydrate (2:1:4)
  • Aspartic acid, L-, magnesium salt (2:1), tetrahydrate
  • L-Aspartic acid, magnesium salt (2:1), tetrahydrate

Work with Magnesium aspartate tetrahydrate

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Stereoisomers, salts and isotopologues

The same compound in another form: other stereochemistry, a salt or hydrate, the free acid or base, or an isotope-labelled version.

Magnesium hydrogen aspartate2068-80-6Anhydrous Aspartic acid56-84-8Free acid Polyaspartic acid25608-40-6Free acid L-Aspartic acid6899-03-2Free acid (+-)-Aspartic acid617-45-8Free acid, stereo not defined D-Aspartic acid1783-96-6Free acid, enantiomer Zinc L-aspartate36393-20-1Salt Potassium magnesium hydrogen DL-aspartate8076-65-1Salt, stereo not defined Monopotassium aspartate1115-63-5Salt Ornithine aspartate3230-94-2Salt Arginine aspartate7675-83-4Salt L-Lysine-L-aspartate27348-32-9Salt

Similar compounds

Sodium glutamate monohydrate6106-04-348 % similar Dl-glutamic acid monohydrate19285-83-747 % similar Dl-asparagine hydrate69833-18-745 % similar Asparagine monohydrate5794-13-843 % similar Magnesium malate869-06-742 % similar Monosodium glutamate142-47-242 % similar Monopotassium glutamate19473-49-542 % similar Monosodium DL-glutamate32221-81-142 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Elsewhere

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