calcium citrate Report issue

Small molecule Approved FDA
AACT ChEMBL DrugBank Drug Central Drugs@FDA KEGG MeSH PubChem

Back

Chemistry

Mol. Mass

592.51

ALogP

Missing data

Rule of 5

Missing data

Rule of 3

Missing data
Details
  • SMILES: [Ca+2].OC[C@@H](O)[C@@H](O)[C@H](O)[C@@H](O)C(=O)[O-].OC[C@@H](O)[C@@H](O[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O)[C@H](O)[C@@H](O)C(=O)[O-]
  • InChIKey: YPCRNBPOUVJVMU-LCGAVOCYSA-L
    InChI=1S/C12H22O12.C6H12O7.Ca/c13-1-3(15)10(7(18)8(19)11(21)22)24-12-9(20)6(17)5(16)4(2-14)23-12;7-1-2(8)3(9)4(10)5(11)6(12)13;/h3-10,12-20H,1-2H2,(H,21,22);2-5,7-11H,1H2,(H,12,13);/q;;+2/p-2/t3-,4-,5+,6+,7-,8-,9-,10-,12+;2-,3-,4+,5-;/m11./s1
  • Chirality: None
  • Inorganic: No
  • Polymer: No

Sources

CHEMBL2219740   ChEMBL
calcium glubionate *

CHEMBL2104594   ChEMBL
calcium glubionate

CHEMBL2106119   ChEMBL
calcium gluconate

CHEMBL2106123   ChEMBL
calcium citrate

CHEMBL2106978   ChEMBL
potassium gluconate

Calcium glubionate   Wikipedia

Calcium citrate   Wikipedia

Calcium citrate malate   Wikipedia

Feedback

Data collection and curation is an ongoing process for CDEK - if you notice any information here to be missing or incorrect, please let us know! When possible, please include a source URL (we verify all data prior to inclusion).

Report issue