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Chemistry

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Also known as: Efical, 31377-05-6, 7y2lvu5ekk, Calcium;(2s)-5-oxopyrrolidine-2-carboxylate, Unii-7y2lvu5ekk, Einecs 250-602-4
Molecular Formula
C10H12CaN2O6
Molecular Weight
296.29  g/mol
InChI Key
YQFZERWESBDNRJ-QHTZZOMLSA-L
FDA UNII
7Y2LVU5EKK

Calcium Pidolate
1 2D Structure

Calcium Pidolate

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
calcium;(2S)-5-oxopyrrolidine-2-carboxylate
2.1.2 InChI
InChI=1S/2C5H7NO3.Ca/c2*7-4-2-1-3(6-4)5(8)9;/h2*3H,1-2H2,(H,6,7)(H,8,9);/q;;+2/p-2/t2*3-;/m00./s1
2.1.3 InChI Key
YQFZERWESBDNRJ-QHTZZOMLSA-L
2.1.4 Canonical SMILES
C1CC(=O)NC1C(=O)[O-].C1CC(=O)NC1C(=O)[O-].[Ca+2]
2.1.5 Isomeric SMILES
C1CC(=O)N[C@@H]1C(=O)[O-].C1CC(=O)N[C@@H]1C(=O)[O-].[Ca+2]
2.2 Other Identifiers
2.2.1 UNII
7Y2LVU5EKK
2.3 Synonyms
2.3.1 MeSH Synonyms

1. Efical

2. Ibercal

3. Tepox Cal

2.3.2 Depositor-Supplied Synonyms

1. Efical

2. 31377-05-6

3. 7y2lvu5ekk

4. Calcium;(2s)-5-oxopyrrolidine-2-carboxylate

5. Unii-7y2lvu5ekk

6. Einecs 250-602-4

7. Ibercal (tn)

8. Calcidone

9. Calcium Pca

10. Calcium Oxoproline

11. L-calcium Pidolate

12. Calcium Pca [inci]

13. Calcium L-pyroglutamate

14. Schembl6687532

15. Calcium Pidolate [mart.]

16. Calcium Pidolate [who-dd]

17. Dtxsid501019893

18. 5-oxo-l-proline Calcium Salt

19. Pidolic Acid Calcium Salt (2:1)

20. D07605

21. L-proline, 5-oxo-, Calcium Salt (2:1)

22. L-pyrrolidone Carboxylic Acid, Calcium Salt

23. Proline, 5-oxo-, Calcium Salt (2:1), L-

24. Q27269001

2.4 Create Date
2007-02-09
3 Chemical and Physical Properties
Molecular Weight 296.29 g/mol
Molecular Formula C10H12CaN2O6
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count6
Rotatable Bond Count0
Exact Mass296.0321270 g/mol
Monoisotopic Mass296.0321270 g/mol
Topological Polar Surface Area139 Ų
Heavy Atom Count19
Formal Charge0
Complexity149
Isotope Atom Count0
Defined Atom Stereocenter Count2
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count3

API Reference Price

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01-Apr-2021
25-Jun-2024
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