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pregnanolone (Q18344323)

From Wikidata
chemical compound
  • Eltanolone
  • (3alpha,5beta)-3-hydroxypregnan-20-one
  • Pregnanolone
  • pregnan-3alpha-ol-20-one
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Language Label Description Also known as
default for all languages
No label defined
    English
    pregnanolone
    chemical compound
    • Eltanolone
    • (3alpha,5beta)-3-hydroxypregnan-20-one
    • Pregnanolone
    • pregnan-3alpha-ol-20-one

    Statements

    chemical structure
    Pregnanolone.svg
    1,180 × 960; 20 KB
    0 references
    mass
    318.256 dalton
    1 reference
    stated in
    PubChem
    PubChem CID
    31402
    language of work or name
    English
    title
    Pregnanolone (English)
    retrieved
    18 November 2016
    chemical formula
    C₂₁H₃₄O₂
    1 reference
    stated in
    PubChem
    PubChem CID
    31402
    language of work or name
    English
    title
    Pregnanolone (English)
    retrieved
    18 November 2016
    canonical SMILES
    CC(=O)C1CCC2C1(CCC3C2CCC4C3(CCC(C4)O)C)C
    1 reference
    stated in
    PubChem
    PubChem CID
    31402
    language of work or name
    English
    title
    Pregnanolone (English)
    retrieved
    18 November 2016
    isomeric SMILES
    CC(=O)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC[C@H]4[C@@]3(CC[C@H](C4)O)C)C
    1 reference
    stated in
    PubChem
    PubChem CID
    31402
    language of work or name
    English
    title
    Pregnanolone (English)
    retrieved
    18 November 2016
    World Health Organisation international non-proprietary name
    eltanolone (English)
    1 reference
    stated in
    ChEBI
    ChEBI ID
    1712
    language of work or name
    English
    title
    3alpha-hydroxy-5beta-pregnan-20-one (English)
    retrieved
    5 October 2016
    Commons category
    Pregnanolone
    0 references

    Identifiers

    Reaxys registry number
    3211364
    1 reference
    stated in
    ChEBI
    ChEBI ID
    1712
    language of work or name
    English
    title
    3alpha-hydroxy-5beta-pregnan-20-one (English)
    retrieved
    5 October 2016
    NSC number
    82867
    0 references
    EC number
    634-188-6
    1 reference
    stated in
    ECHA Substance Infocard database
    ECHA Substance Infocard ID
    100.162.192
    retrieved
    27 December 2018
    title
    1-[(1S,2S,5R,7R,10R,11S,14S,15S)-5-hydroxy-2,15-dimethyltetracyclo[8.7.0.0²,⁷.0¹¹,¹⁵]heptadecan-14-yl]ethan-1-one (English)
    quotation
    CAS no.: 128-20-1 (English)
    ECHA Substance Infocard ID
    100.162.192
    1 reference
    stated in
    ECHA Substance Infocard database
    ECHA Substance Infocard ID
    100.162.192
    retrieved
    27 December 2018
    title
    1-[(1S,2S,5R,7R,10R,11S,14S,15S)-5-hydroxy-2,15-dimethyltetracyclo[8.7.0.0²,⁷.0¹¹,¹⁵]heptadecan-14-yl]ethan-1-one (English)
    quotation
    CAS no.: 128-20-1 (English)
    KEGG ID
    C05480
    1 reference
    stated in
    ChEBI
    ChEBI ID
    1712
    language of work or name
    English
    title
    3alpha-hydroxy-5beta-pregnan-20-one (English)
    retrieved
    5 October 2016
    PDB ligand ID
    P9N
    0 references
    Freebase ID
    /m/01117bys
    0 references
     
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