tinosporide (Q15427879)

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chemical compound
  • (2S,4aR,6aR,7S,7aS,8aS,9S,9aS,9bS)-2-(3-furanyl)dodecahydro-7-hydroxy-6a,9b-dimethyl-9,7-(epoxymethano)-4H-oxireno[6,7]naphtho[2,1-c]pyran-4,11-dione
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    English
    tinosporide
    chemical compound
    • (2S,4aR,6aR,7S,7aS,8aS,9S,9aS,9bS)-2-(3-furanyl)dodecahydro-7-hydroxy-6a,9b-dimethyl-9,7-(epoxymethano)-4H-oxireno[6,7]naphtho[2,1-c]pyran-4,11-dione

    Statements

    chemical structure
    Tinosporide.svg
    480 × 565; 19 KB
    0 references
    mass
    374.136553±0 dalton
    1 reference
    stated in
    PubChem
    PubChem CID
    167631
    language of work or name
    English
    title
    2-(furan-3-yl)-7-hydroxy-6a,9b-dimethyldodecahydro-4h-9,7-(epoxymethano)[1]benzoxireno[3,4-f]isochromene-4,11-dione (English)
    retrieved
    21 September 2016
    chemical formula
    C₂₀H₂₂O₇
    1 reference
    stated in
    PubChem
    PubChem CID
    167631
    language of work or name
    English
    title
    2-(furan-3-yl)-7-hydroxy-6a,9b-dimethyldodecahydro-4h-9,7-(epoxymethano)[1]benzoxireno[3,4-f]isochromene-4,11-dione (English)
    retrieved
    21 September 2016
    canonical SMILES
    CC12CCC3C(=O)OC(CC3(C1C4C5C(C2(C(=O)O4)O)O5)C)C6=COC=C6
    1 reference
    stated in
    PubChem
    PubChem CID
    167631
    language of work or name
    English
    title
    2-(furan-3-yl)-7-hydroxy-6a,9b-dimethyldodecahydro-4h-9,7-(epoxymethano)[1]benzoxireno[3,4-f]isochromene-4,11-dione (English)
    retrieved
    21 September 2016

    Identifiers

    InChI
    InChI=1S/C20H22O7/c1-18-7-11(9-4-6-24-8-9)25-16(21)10(18)3-5-19(2)14(18)12-13-15(26-13)20(19,23)17(22)27-12/h4,6,8,10-15,23H,3,5,7H2,1-2H3
    1 reference
    stated in
    PubChem
    PubChem CID
    167631
    language of work or name
    English
    title
    2-(furan-3-yl)-7-hydroxy-6a,9b-dimethyldodecahydro-4h-9,7-(epoxymethano)[1]benzoxireno[3,4-f]isochromene-4,11-dione (English)
    retrieved
    21 September 2016
    InChIKey
    TXOMRNMZLZXJQP-UHFFFAOYSA-N
    1 reference
    stated in
    PubChem
    PubChem CID
    167631
    language of work or name
    English
    title
    2-(furan-3-yl)-7-hydroxy-6a,9b-dimethyldodecahydro-4h-9,7-(epoxymethano)[1]benzoxireno[3,4-f]isochromene-4,11-dione (English)
    retrieved
    21 September 2016
    ChemSpider ID
    146649
    1 reference
    stated in
    ChemSpider
    ChemSpider ID
    146649
    language of work or name
    English
    title
    5-(3-Furyl)-12-hydroxy-3,11-dimethyl-6,14,16-trioxapentacyclo[10.3.2.0~2,11~.0~3,8~.0~13,15~]heptadecane-7,17-dione (English)
    retrieved
    21 September 2016
    PubChem CID
    167631
    2 references
    stated in
    PubChem
    PubChem CID
    167631
    language of work or name
    English
    title
    2-(furan-3-yl)-7-hydroxy-6a,9b-dimethyldodecahydro-4h-9,7-(epoxymethano)[1]benzoxireno[3,4-f]isochromene-4,11-dione (English)
    retrieved
    21 September 2016
    matched by identifier from
    InChIKey
    InChIKey
    TXOMRNMZLZXJQP-UHFFFAOYSA-N
     
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