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    Technical details about Ronopterin, learn more about the structure, uses, toxicity, action, side effects and more

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    Ronopterin

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    2D Structure
    Also known as: Ronopterin, Ronopterin [inn], Vas203, 185243-78-1, Vas-203, 1d1z87ay23
    Molecular Formula
    C9H16N6O2
    Molecular Weight
    240.26  g/mol
    InChI Key
    NDSDGUULXHNXGA-RPDRRWSUSA-N
    FDA UNII
    1D1Z87AY23
    Ronopterin has been used in trials studying the treatment of Traumatic Brain Injury.
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    (1R,2S)-1-[(6R)-2,4-diamino-5,6,7,8-tetrahydropteridin-6-yl]propane-1,2-diol
    2.1.2 InChI
    InChI=1S/C9H16N6O2/c1-3(16)6(17)4-2-12-8-5(13-4)7(10)14-9(11)15-8/h3-4,6,13,16-17H,2H2,1H3,(H5,10,11,12,14,15)/t3-,4+,6-/m0/s1
    2.1.3 InChI Key
    NDSDGUULXHNXGA-RPDRRWSUSA-N
    2.1.4 Canonical SMILES
    CC(C(C1CNC2=NC(=NC(=C2N1)N)N)O)O
    2.1.5 Isomeric SMILES
    C[C@@H]([C@@H]([C@H]1CNC2=NC(=NC(=C2N1)N)N)O)O
    2.2 Other Identifiers
    2.2.1 UNII
    1D1Z87AY23
    2.3 Synonyms
    2.3.1 MeSH Synonyms

    1. 2,4-diamino-5,6,7,8-tetrahydro-6(1,2-dihydroxypropyl)pteridine

    2. 4-amino-h4biopterin

    3. 4-amino-tetrahydrobiopterin

    4. Ronopterin

    5. Vas203

    2.3.2 Depositor-Supplied Synonyms

    1. Ronopterin

    2. Ronopterin [inn]

    3. Vas203

    4. 185243-78-1

    5. Vas-203

    6. 1d1z87ay23

    7. (1r,2s)-1-[(6r)-2,4-diamino-5,6,7,8-tetrahydropteridin-6-yl]propane-1,2-diol

    8. 1,2-propanediol, 1-(2,4-diamino-1,5,6,7-tetrahydro-6-pteridinyl)-, (1r,2s)-

    9. 1,2-propanediol, 1-(2,4-diamino-5,6,7,8-tetrahydro-6-pteridinyl)-, (1r,2s)-

    10. (1r,2s)-1-((r)-2,4-diamino-5,6,7,8-tetrahydropteridin-6-yl)propane-1,2-diol

    11. Unii-1d1z87ay23

    12. (1r,2s)-1-((6r)-2,4-diamino-5,6,7,8-tetrahydropteridin-6-yl)propane-1,2-diol

    13. 4-amino-h4biopterin

    14. 4-amino 5,6,7,8-tetrahydrobiopterin

    15. Ronopterin [who-dd]

    16. Ronopterin, (6r)-

    17. Chembl1230245

    18. Dtxsid9040394

    19. Db12575

    20. (1r,2s)-1-((6r)-2,4-diamino-5,6,7,8-tetrahydropteridin- 6-yl)propane-1,2-diol

    21. 1,2-propanediol, 1-((6r)-2,4-diamino-5,6,7,8-tetrahydro-6-pteridinyl)-, (1r,2s)-

    22. 2,4-diamino-6-[2,3-dihydroxy-prop-3-yl]-5,6,7,8-tetrahydropteridine

    23. Q27252260

    24. 2,4-diamino-5,6,7,8-tetrahydro-6(1,2-dihydroxypropyl)pteridine

    25. (1r,2s)-1-(2,4-diamino-5,6,7,8-tetrahydro-6-pteridinyl)-1,2-propanediol

    26. (6r)-2,4-diamino-5,6,7,8-tetrahydro-6-(-erythro-1,2-dihydroxypropyl)pteridine

    27. (6r)-2,4-diamino-6beta-[(1r,2s)-1,2-dihydroxypropyl]-5,6,7,8-tetrahydropteridine

    2.4 Create Date
    2005-11-29
    3 Chemical and Physical Properties
    Molecular Weight 240.26 g/mol
    Molecular Formula C9H16N6O2
    XLogP3-1.2
    Hydrogen Bond Donor Count6
    Hydrogen Bond Acceptor Count8
    Rotatable Bond Count2
    Exact Mass240.13347377 g/mol
    Monoisotopic Mass240.13347377 g/mol
    Topological Polar Surface Area142 Ų
    Heavy Atom Count17
    Formal Charge0
    Complexity268
    Isotope Atom Count0
    Defined Atom Stereocenter Count3
    Undefined Atom Stereocenter Count0
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count1