Please Wait
Applying Filters...
menu
    • menu
    Athena Pharmaceutiques is a Partner of Choice for Drug Delivery & Life Cycle Management.

    Virtual Booth

    Contact Supplier

    Kikkoman Biochemifa Company advances global health and safety through precision-driven innovation in biotech and food testing.

    Virtual Booth

    Contact Supplier

    Rusan Pharma: Over 30 years of specializing in the treatment of Addiction and Pain Management.

    Virtual Booth

    Contact Supplier

    TransoPharm USA works in the Sourcing and Management of Active Pharmaceutical Ingredients.

    Virtual Booth

    Contact Supplier

    Moehs Group, a reference company in the production of pharmaceutical active ingredients.

    Virtual Booth

    Contact Supplier

    pharmacompass-2-m-2025-10-20

    Virtual Booth

    An Enquiry

    Menu

    Larsucosterol

    ACTIVE PHARMA INGREDIENTS

    DEVELOPMENTS

    DIGITAL CONTENT

    PharmaCompass
    Xls

    Filters

    clear-filterReset all filters
    2D Structure
    Also known as: Dur-928 sodium, Larsucosterol sodium, Dv-928 sodium, 71a5jopbe8, Larsucosterol sodium [usan], 1174047-40-5
    Molecular Formula
    C27H45NaO5S
    Molecular Weight
    504.7  g/mol
    InChI Key
    OEGAOHNRCSZIRO-KSGNISEOSA-M
    FDA UNII
    71A5JOPBE8
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    sodium;[(3S,8S,9S,10R,13R,14S,17R)-17-[(2R)-6-hydroxy-6-methylheptan-2-yl]-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] sulfate
    2.1.2 InChI
    InChI=1S/C27H46O5S.Na/c1-18(7-6-14-25(2,3)28)22-10-11-23-21-9-8-19-17-20(32-33(29,30)31)12-15-26(19,4)24(21)13-16-27(22,23)5;/h8,18,20-24,28H,6-7,9-17H2,1-5H3,(H,29,30,31);/q;+1/p-1/t18-,20+,21+,22-,23+,24+,26+,27-;/m1./s1
    2.1.3 InChI Key
    OEGAOHNRCSZIRO-KSGNISEOSA-M
    2.1.4 Canonical SMILES
    CC(CCCC(C)(C)O)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)OS(=O)(=O)[O-])C)C.[Na+]
    2.1.5 Isomeric SMILES
    C[C@H](CCCC(C)(C)O)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC=C4[C@@]3(CC[C@@H](C4)OS(=O)(=O)[O-])C)C.[Na+]
    2.2 Other Identifiers
    2.2.1 UNII
    71A5JOPBE8
    2.3 Synonyms
    2.3.1 Depositor-Supplied Synonyms

    1. Dur-928 Sodium

    2. Larsucosterol Sodium

    3. Dv-928 Sodium

    4. 71a5jopbe8

    5. Larsucosterol Sodium [usan]

    6. 1174047-40-5

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

    8. Larsucosterol (sodium)

    9. Unii-71a5jopbe8

    10. Chembl4802246

    11. Cs-0254313

    12. 5-cholesten-3beta-25-diol-3-sulfate Sodium Salt

    13. 5-cholesten-3.beta., 25-diol 3-sulfate Sodium

    14. 5-cholesten-3.beta.-25-diol-3-sulfate Sodium Salt

    15. 5-cholesten-3.beta., 25-diol 3-sulfate Sodium Salt

    16. 5-cholesten-3beta, 25-diol 3-sulfate Sodium Salt (25hc3s)

    17. 25-hydroxycholesterol-3-sulfate, 25-hydroxycholesterol-3-sulfate (sodium Salt), Powder

    2.4 Create Date
    2009-04-06
    3 Chemical and Physical Properties
    Molecular Weight 504.7 g/mol
    Molecular Formula C27H45NaO5S
    Hydrogen Bond Donor Count1
    Hydrogen Bond Acceptor Count5
    Rotatable Bond Count7
    Exact Mass504.28853999 g/mol
    Monoisotopic Mass504.28853999 g/mol
    Topological Polar Surface Area95 Ų
    Heavy Atom Count34
    Formal Charge0
    Complexity865
    Isotope Atom Count0
    Defined Atom Stereocenter Count8
    Undefined Atom Stereocenter Count0
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count2