Please Wait
Applying Filters...
menu
    • menu
    Granules India Limited has high volume world-class facilities for APIs, PFIs, & FDFs, serving customers in over 80 countries.

    Virtual Booth

    Contact Supplier

    Jai Radhe Sales is your partner for all your sourcing needs.

    Virtual Booth

    Contact Supplier

    xyz-pharma-m-2024-10-07

    Virtual Booth

    Contact Supplier

    Egis is a Hungarian generic pharma company with 110 years history. Our activities incorporate all areas of the pharma value chain.

    Virtual Booth

    Contact Supplier

    Biophore is a research-driven global pharmaceutical company focused on niche APIs for the generic industry.

    Virtual Booth

    Contact Supplier

    xyz-pharma-m-2024-10-07

    Virtual Booth

    Contact Supplier

    Menu

    CAS 151533-22-1

    PharmaCompass
    Xls

    Filters

    clear-filterReset all filters
    2D Structure
    Also known as: 151533-22-1, Calcium levomefolate, Bodyfolin, Metafolin, Nutrifolin, Levomefolinate calcium
    Molecular Formula
    C20H23CaN7O6
    Molecular Weight
    497.5  g/mol
    InChI Key
    VWBBRFHSPXRJQD-QNTKWALQSA-L
    FDA UNII
    A9R10K3F2F
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    calcium;(2S)-2-[[4-[[(6S)-2-amino-5-methyl-4-oxo-3,6,7,8-tetrahydropteridin-6-yl]methylamino]benzoyl]amino]pentanedioate
    2.1.2 InChI
    InChI=1S/C20H25N7O6.Ca/c1-27-12(9-23-16-15(27)18(31)26-20(21)25-16)8-22-11-4-2-10(3-5-11)17(30)24-13(19(32)33)6-7-14(28)29;/h2-5,12-13,22H,6-9H2,1H3,(H,24,30)(H,28,29)(H,32,33)(H4,21,23,25,26,31);/q;+2/p-2/t12-,13-;/m0./s1
    2.1.3 InChI Key
    VWBBRFHSPXRJQD-QNTKWALQSA-L
    2.1.4 Canonical SMILES
    CN1C(CNC2=C1C(=O)NC(=N2)N)CNC3=CC=C(C=C3)C(=O)NC(CCC(=O)[O-])C(=O)[O-].[Ca+2]
    2.1.5 Isomeric SMILES
    CN1[C@H](CNC2=C1C(=O)NC(=N2)N)CNC3=CC=C(C=C3)C(=O)N[C@@H](CCC(=O)[O-])C(=O)[O-].[Ca+2]
    2.2 Other Identifiers
    2.2.1 UNII
    A9R10K3F2F
    2.3 Synonyms
    2.3.1 MeSH Synonyms

    1. Metafolin

    2. N-(4-(((2-amino-1,4,5,6,7,8-hexahydro-5-methyl-4-oxo-6-pteridinyl)methyl)amino)benzoyl)-l-glutamic Acid Calcium Salt

    3. Safyral

    2.3.2 Depositor-Supplied Synonyms

    1. 151533-22-1

    2. Calcium Levomefolate

    3. Bodyfolin

    4. Metafolin

    5. Nutrifolin

    6. Levomefolinate Calcium

    7. Lmca

    8. L-methylfolate Calcium

    9. Extrafolate-s

    10. Levomefolate (calcium)

    11. Deplin

    12. Levomefolate Calcium [usan]

    13. L-5-mthf-ca

    14. L-methylfolate-calcium

    15. Calcium L-5-methyltetrahydrofolate

    16. Lmc-a

    17. L-5-methyl Tetrahydrofolic

    18. Bay86-7660

    19. Bay 86-7660

    20. L-5-methyltetrahydrofolate Calcium

    21. A9r10k3f2f

    22. (s)-2-(4-((((s)-2-amino-5-methyl-4-oxo-3,4,5,6,7,8-hexahydropteridin-6-yl)methyl)amino)benzamido)pentanedioic Acid, Calcium Salt

    23. Metafolin (tn)

    24. (6s)-5-methyltetrahydrofolic Acid Calcium Salt

    25. Levomefolate Calcium (usan)

    26. Calcium;(2s)-2-[[4-[[(6s)-2-amino-5-methyl-4-oxo-3,6,7,8-tetrahydropteridin-6-yl]methylamino]benzoyl]amino]pentanedioate

    27. L-5-methyletrahydrofolate Calcium

    28. Calcium N-(4-((((6s)-2-amino-5-methyl-4-oxo-1,4,5,6,7,8-hexahydropteridin-6-yl)methyl)amino)benzoyl)-l-glutamate

    29. Unii-a9r10k3f2f

    30. Calcium L-methylfolate

    31. Ndi 638 [fdms]

    32. Chembl1615371

    33. Ndi 638

    34. Chebi:189695

    35. Calcium;(2s)-2-[[4-[[(6s)-2-amino-5-methyl-4-oxo-1,6,7,8-tetrahydropteridin-6-yl]methylamino]benzoyl]amino]pentanedioate

    36. Levomefolate Calcium [vandf]

    37. Calcium Levomefolate [mart.]

    38. Mfcd18642975

    39. Calcium Levomefolate [who-dd]

    40. Akos025117256

    41. Akos025402270

    42. Ac-7457

    43. Cs-1066

    44. Gs-6017

    45. Hy-17383

    46. Levomefolate Calcium [orange Book]

    47. N-(4-(((2-amino-1,4,5,6,7,8-hexahydro-5-methyl-4-oxo-6-pteridinyl)methyl)amino)benzoyl)-l-glutamic Acid Calcium Salt

    48. Beyaz Component Levomefolate Calcium

    49. Safyral Component Levomefolate Calcium

    50. Levomefolate Calcium Component Of Beyaz

    51. D09354

    52. Calcium L-5-methyltetrahydrofolate [dsc]

    53. Levomefolate Calcium Component Of Safyral

    54. L-5-methyltetrahydrofolic Acid, Calcium Salt

    55. Q27273818

    56. 6(s)-5-methyltetrahydrofolic Acid, Calcium Salt [ndi]

    57. (s)-2-(4-((((s)-2-amino-5-methyl-4-oxo-3,4,5,6,7,8-hexahydropteridin-6-yl)methyl)amino)benzamido)pentanedioicacid,calciumsalt

    58. 129025-21-4

    59. Calcium (2s)-2-[4-({[(6s)-2-amino-5-methyl-4-oxo-3,4,5,6,7,8-hexahydropteridin-6-yl]methyl}amino)benzamido]pentanedioate

    60. Calcium (2s)-2-{[4-({[(6s)-2-amino-5-methyl-4-oxo-3,4,5,6,7,8-hexahydropteridin-6-yl]methyl}amino)phenyl]formamido}pentanedioate

    61. Calcium (4-((((s)-2-amino-5-methyl-4-oxo-3,4,5,6,7,8-hexahydropteridin-6-yl)methyl)amino)benzoyl)-l-glutamate

    62. L-glutamic Acid, N-(4-((((6s)-2-amino-1,4,5,6,7,8-hexahydro-5-methyl-4-oxo-6-pteridinyl)methyl)amino)benzoyl)-, Calcium Salt (1:1)

    2.4 Create Date
    2019-01-15
    3 Chemical and Physical Properties
    Molecular Weight 497.5 g/mol
    Molecular Formula C20H23CaN7O6
    Hydrogen Bond Donor Count5
    Hydrogen Bond Acceptor Count10
    Rotatable Bond Count7
    Exact Mass497.1335723 g/mol
    Monoisotopic Mass497.1335723 g/mol
    Topological Polar Surface Area204 Ų
    Heavy Atom Count34
    Formal Charge0
    Complexity854
    Isotope Atom Count0
    Defined Atom Stereocenter Count2
    Undefined Atom Stereocenter Count0
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count2