Chemical Compound

Magnesium dehydrocholate

CAS Registry Number 7786-84-7
Magnesium dehydrocholate chemical structure
Primary Record

Magnesium dehydrocholate

In stock
7,862 g
Purity
99.4 %
CAS
7786-84-7

Compound Identifiers & Properties

CAS
7786-84-7
PubChem CID
118856755
SMILES
C[C@H](CCC(=O)[O-])[C@H]1CCC2[C@@]1(C(=O)CC3C2C(=O)C[C@H]4[C@@]3(CCC(=O)C4)C)C.C[C@H](CCC(=O)[O-])[C@H]1CCC2[C@@]1(C(=O)CC3C2C(=O)CC4[C@@]3(CCC(=O)C4)C)C.[Mg+2]
Canonical SMILES
C[C@H](CCC(=O)[O-])[C@H]1CCC2C3C(=O)CC4CC(=O)CC[C@]4(C)C3CC(=O)[C@@]21C.C[C@H](CCC(=O)[O-])[C@H]1CCC2C3C(=O)C[C@@H]4CC(=O)CC[C@]4(C)C3CC(=O)[C@@]21C.[Mg+2]

Names & Synonyms

  • Magnesium dehydrocholate
  • UNII-0ELP4NGB7D
  • C24H34O5.1/2Mg
  • EINECS 232-105-4
  • C24-H34-O5.1/2Mg
  • magnesium bis[3,7,12-trioxo-5beta-cholan-24-oate]
  • Magnesium bis(3,7,12-trioxo-5beta-cholan-24-oate)
  • Cholan-24-oic acid, 3,7,12-trioxo-, magnesium salt, (5.beta.)-
  • 7786-84-7