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Coumestans

Description:

Polycyclic aromatic compounds containing a coumestan moiety, which consists of a benzoxole fused to a chromen-2-one to form 1-Benzoxolo[3,2-c]chromen-6-one. They are oxidation products of pterocarpan.

Ancestors:

Organic compounds ⮕ Phenylpropanoids and polyketides ⮕ Isoflavonoids ⮕ Coumestans

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  1. Medicagol
    Medicagol
    CAS: 1983-72-8 PubChem CID: 5319322
    ≥98%
    Out of Stock Item #: M709635
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    Technical Identifiers
    IUPAC Name
    16-hydroxy-5,7,11,19-tetraoxapentacyclo[10.8.0.02,10.04,8.013,18]icosa-1(12),2,4(8),9,13(18),14,16-heptaen-20-one
    SMILES
    C1OC2=C(O1)C=C3C(=C2)C4=C(O3)C5=C(C=C(C=C5)O)OC4=O
    InChIKey
    URMVEUAWRUQHON-UHFFFAOYSA-N
    InChI
    1S/C16H8O6/c17-7-1-2-8-10(3-7)22-16(18)14-9-4-12-13(20-6-19-12)5-11(9)21-15(8)14/h1-5,17H,6H2
  2. Demethylwedelolactone
    Demethylwedelolactone
    CAS: 6468-55-9 PubChem CID: 5489605 Formula: C15H8O7 Molecular Weight: 300.23
    Solid Moligand™ ? Moligand™ — Aladdin's line of ligands and bioactive small molecules. Use for receptor, pathway, and binding studies needing defined small-molecule tools. ≥99%
    Out of Stock Item #: D647982
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    Technical Identifiers
    IUPAC Name
    1,3,8,9-tetrahydroxy-[1]benzofuro[3,2-c]chromen-6-one
    SMILES
    C1=C(C=C2C(=C1O)C3=C(C4=CC(=C(C=C4O3)O)O)C(=O)O2)O
    InChIKey
    LUTYTNLPIUCKBJ-UHFFFAOYSA-N
    InChI
    1S/C15H8O7/c16-5-1-9(19)13-11(2-5)22-15(20)12-6-3-7(17)8(18)4-10(6)21-14(12)13/h1-4,16-19H
    Synonyms
    MS-24319 | A867843 | Norwedelolactone | AKOS015897135 | CHEBI:191036 | SCHEMBL3364302 | HY-N2028 | 1,3,8,9-TETRAHYDRO...
  3. no_selection
    Coumestrol
    CAS: 479-13-0 EC Number: 207-525-6 Formula: C15H8O5 Molecular Weight: 268.22
    Solid Moligand™ ? Moligand™ — Aladdin's line of ligands and bioactive small molecules. Use for receptor, pathway, and binding studies needing defined small-molecule tools. ≥98%
    Out of Stock Item #: C609557
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    Technical Identifiers
    IUPAC Name
    3,9-dihydroxy-[1]benzofuro[3,2-c]chromen-6-one
    SMILES
    C1=CC2=C(C=C1O)OC3=C2C(=O)OC4=C3C=CC(=C4)O
    InChIKey
    ZZIALNLLNHEQPJ-UHFFFAOYSA-N
    InChI
    1S/C15H8O5/c16-7-1-3-9-11(5-7)19-14-10-4-2-8(17)6-12(10)20-15(18)13(9)14/h1-6,16-17H
    Synonyms
    3,9-Dihydroxy-6H-[1]benzofuro[3,2-c]chromen-6-one | Cumoesterol | Cumoestrol | Cumostrol | 3,9-Dihydroxycoumestan | C...
  4. Wedelolactone
    Wedelolactone
    CAS: 524-12-9 EC Number: 637-054-5 PubChem CID: 5281813 Formula: C16H10O7 Molecular Weight: 314.25
    Moligand™ ? Moligand™ — Aladdin's line of ligands and bioactive small molecules. Use for receptor, pathway, and binding studies needing defined small-molecule tools. 10mM in DMSO
    In Stock Item #: W424498
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    Technical Identifiers
    IUPAC Name
    1,8,9-trihydroxy-3-methoxy-[1]benzofuro[3,2-c]chromen-6-one
    SMILES
    COC1=CC(=C2C(=C1)OC(=O)C3=C2OC4=CC(=C(C=C43)O)O)O
    InChIKey
    XQDCKJKKMFWXGB-UHFFFAOYSA-N
    InChI
    1S/C16H10O7/c1-21-6-2-10(19)14-12(3-6)23-16(20)13-7-4-8(17)9(18)5-11(7)22-15(13)14/h2-5,17-19H,1H3
    Synonyms
    7-Methoxy-5,11,12-trihydroxycoumestan | 7-Methoxy-5,11,12-trihydroxy-coumestan | IKK Inhibitor II | NCGC00163667-01 |...
  5. Psoralidin
    Psoralidin
    CAS: 18642-23-4 EC Number: 683-176-7 PubChem CID: 5281806 Formula: C20H16O5 Molecular Weight: 336.34
    10mM in DMSO
    In Stock Item #: P422276
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    Technical Identifiers
    IUPAC Name
    3,9-dihydroxy-2-(3-methylbut-2-enyl)-[1]benzofuro[3,2-c]chromen-6-one
    SMILES
    CC(=CCC1=CC2=C(C=C1O)OC(=O)C3=C2OC4=C3C=CC(=C4)O)C
    InChIKey
    YABIJLLNNFURIJ-UHFFFAOYSA-N
    InChI
    1S/C20H16O5/c1-10(2)3-4-11-7-14-17(9-15(11)22)25-20(23)18-13-6-5-12(21)8-16(13)24-19(14)18/h3,5-9,21-22H,4H2,1-2H3
    Synonyms
    3,9-dihydroxy-2-(3-methylbut-2-en-1-yl)-6H-[1]benzofuro[3,2-c][1]benzopyran-6-one | UNII-G16ZUQ069L | BDBM246524 | HY...
  6. 3,9-Di-O-methylcoumestrol
    3,9-Di-O-methylcoumestrol
    CAS: 3172-99-4 Formula: C17H12O5 Molecular Weight: 296.27
    Solid Moligand™ ? Moligand™ — Aladdin's line of ligands and bioactive small molecules. Use for receptor, pathway, and binding studies needing defined small-molecule tools. ≥95%
    In Stock Item #: C334050
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    Technical Identifiers
    IUPAC Name
    3,9-dimethoxy-[1]benzofuro[3,2-c]chromen-6-one
    SMILES
    COC1=CC2=C(C=C1)C3=C(O2)C4=C(C=C(C=C4)OC)OC3=O
    InChIKey
    PXHLPCBBXPHBHP-UHFFFAOYSA-N
    InChI
    1S/C17H12O5/c1-19-9-3-5-11-13(7-9)21-16-12-6-4-10(20-2)8-14(12)22-17(18)15(11)16/h3-8H,1-2H3
    Synonyms
    LMPK12090020 | J-018517 | 3,9-Dimethylcoumestan | DTXSID60382935 | 3,9-dimethoxy-[1]benzofuro[3,2-c]chromen-6-one | C...
  7. Psoralidin
    Psoralidin
    CAS: 18642-23-4 PubChem CID: 5281806 Formula: C20H16O5 Molecular Weight: 336.34
    ≥98%(HPLC)
    In Stock Item #: P168140
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    Pricing & Pack Sizes
    Technical Identifiers
    IUPAC Name
    3,9-dihydroxy-2-(3-methylbut-2-enyl)-[1]benzofuro[3,2-c]chromen-6-one
    SMILES
    CC(=CCC1=CC2=C(C=C1O)OC(=O)C3=C2OC4=C3C=CC(=C4)O)C
    InChIKey
    YABIJLLNNFURIJ-UHFFFAOYSA-N
    InChI
    1S/C20H16O5/c1-10(2)3-4-11-7-14-17(9-15(11)22)25-20(23)18-13-6-5-12(21)8-16(13)24-19(14)18/h3,5-9,21-22H,4H2,1-2H3
    Synonyms
    3,9-dihydroxy-2-(3-methylbut-2-en-1-yl)-6H-[1]benzofuro[3,2-c][1]benzopyran-6-one | UNII-G16ZUQ069L | BDBM246524 | HY...
  8. Wedelolactone
    Wedelolactone
    CAS: 524-12-9 EC Number: 637-054-5 PubChem CID: 5281813 Formula: C16H10O7 Molecular Weight: 314.25
    Moligand™ ? Moligand™ — Aladdin's line of ligands and bioactive small molecules. Use for receptor, pathway, and binding studies needing defined small-molecule tools. ≥98%(HPLC)
    In Stock Item #: W124219
    View Product
    Pricing & Pack Sizes
    Technical Identifiers
    IUPAC Name
    1,8,9-trihydroxy-3-methoxy-[1]benzofuro[3,2-c]chromen-6-one
    SMILES
    COC1=CC(=C2C(=C1)OC(=O)C3=C2OC4=CC(=C(C=C43)O)O)O
    InChIKey
    XQDCKJKKMFWXGB-UHFFFAOYSA-N
    InChI
    1S/C16H10O7/c1-21-6-2-10(19)14-12(3-6)23-16(20)13-7-4-8(17)9(18)5-11(7)22-15(13)14/h2-5,17-19H,1H3
    Synonyms
    7-Methoxy-5,11,12-trihydroxycoumestan | 7-Methoxy-5,11,12-trihydroxy-coumestan | IKK Inhibitor II | NCGC00163667-01 |...
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