loader
Please Wait
Applying Filters...

AbbVie Contract Manufacturing AbbVie Contract Manufacturing

X
menu

    Market Place

    Market Place

    Post Enquiry

    Post Enquiry
    menu

    Technical details about Sodium Prasterone Sulfate Dihydrate, learn more about the structure, uses, toxicity, action, side effects and more

    Client Email Product
    Menu

    Sodium Prasterone Sulfate Dihydrate

    APIs // Active Pharmaceutical Ingredients

    PharmaCompass

    Biopharma Group offers CDMO services with expertise in contract R&D for dried products & liquid formulations.

    Rochem, your partner in developing, sourcing, and supplying pharmaceutical & animal health ingredients of Chinese origin.

    2D Structure
    1. Also known as: 78590-17-7, Prasterone sulfate sodium hydrate, Prasterone sodium sulfate dihydrate, E1cr8487en, Dehydroisoandrosterone 3-sulfate sodium salt dihydrate, Sodium;[(3s,8r,9s,10r,13s,14s)-10,13-dimethyl-17-oxo-1,2,3,4,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-3-yl] sulfate;dihydrate
    Molecular Formula
    C19H31NaO7S
    Molecular Weight
    426.5  g/mol
    InChI Key
    NLNMKDUYGPNWAO-OXNWJOIVSA-M
    FDA UNII
    E1CR8487EN
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    sodium;[(3S,8R,9S,10R,13S,14S)-10,13-dimethyl-17-oxo-1,2,3,4,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-3-yl] sulfate;dihydrate
    2.1.2 InChI
    InChI=1S/C19H28O5S.Na.2H2O/c1-18-9-7-13(24-25(21,22)23)11-12(18)3-4-14-15-5-6-17(20)19(15,2)10-8-16(14)18;;;/h3,13-16H,4-11H2,1-2H3,(H,21,22,23);;2*1H2/q;+1;;/p-1/t13-,14-,15-,16-,18-,19-;;;/m0.../s1
    2.1.3 InChI Key
    NLNMKDUYGPNWAO-OXNWJOIVSA-M
    2.1.4 Canonical SMILES
    CC12CCC3C(C1CCC2=O)CC=C4C3(CCC(C4)OS(=O)(=O)[O-])C.O.O.[Na+]
    2.1.5 Isomeric SMILES
    C[C@]12CC[C@H]3[C@H]([C@@H]1CCC2=O)CC=C4[C@@]3(CC[C@@H](C4)OS(=O)(=O)[O-])C.O.O.[Na+]
    2.2 Other Identifiers
    2.2.1 UNII
    E1CR8487EN
    2.3 Synonyms
    2.3.1 Depositor-Supplied Synonyms

    1. 78590-17-7

    2. Prasterone Sulfate Sodium Hydrate

    3. Prasterone Sodium Sulfate Dihydrate

    4. E1cr8487en

    5. Dehydroisoandrosterone 3-sulfate Sodium Salt Dihydrate

    6. Sodium;[(3s,8r,9s,10r,13s,14s)-10,13-dimethyl-17-oxo-1,2,3,4,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-3-yl] Sulfate;dihydrate

    7. Sodium Prasterone Sulfate [jan]

    8. Prasterone Sulfate Sodium Salt Dihydrate

    9. Unii-e1cr8487en

    10. Mylis (tn)

    11. Ncgc00093811-01

    12. Dsstox_cid_25764

    13. Dsstox_rid_81106

    14. Dsstox_gsid_45764

    15. Chembl3188432

    16. Dtxsid9045764

    17. Chebi:32148

    18. Tox21_111223

    19. 3-(sulfooxy)androst-5-en-17-one Sodium Salt, Dihydrate, (3beta)-

    20. Androst-5-en-17-one, 3-(sulfooxy)-, Sodium Salt, Dihydrate, (3beta)-

    21. Sodium Prasterone Sulfate Hydrate

    22. Sodium Prasterone Sulfate Hydrate (jp17)

    23. Cas-78590-17-7

    24. D01616

    25. Prasterone Sodium Sulfate Hydrate [jan]

    26. 5-androsten-3beta-ol-17-one Sulphate,sodium Salt

    27. Q27276745

    28. 5-androsten-3b-ol-17-one Sulfate Sodium Salt Dihydrate

    29. Dehydroepiandrosterone Sulfate Sodium Salt Dihydrate

    30. 3.beta.-hydroxy-5-androsten-17-one Sodium Sulfate Dihydrate

    31. Androst-5-en-17-one, 3-(sulfooxy)-, Sodium Salt, Dihydrate, (3.beta.)-

    32. Androst-5-en-17-one, 3.beta.-hydroxy-, Hydrogen Sulfate, Sodium Salt, Dihydrate

    33. Dehydroisoandrosterone 3-sulfate Sodium Salt Dihydrate, >=93% (tlc), Powder

    2.4 Create Date
    2008-02-05
    3 Chemical and Physical Properties
    Molecular Weight 426.5 g/mol
    Molecular Formula C19H31NaO7S
    Hydrogen Bond Donor Count2
    Hydrogen Bond Acceptor Count7
    Rotatable Bond Count2
    Exact Mass426.16881878 g/mol
    Monoisotopic Mass426.16881878 g/mol
    Topological Polar Surface Area93.9 Ų
    Heavy Atom Count28
    Formal Charge0
    Complexity727
    Isotope Atom Count0
    Defined Atom Stereocenter Count6
    Undefined Atom Stereocenter Count0
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count4
    Post Enquiry
    POST ENQUIRY