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Isocoumarins and derivatives

Description:

Polycyclic compounds containing an isochromane which bears a ketone at the carbon C1.

Ancestors:

Organic compounds ⮕ Phenylpropanoids and polyketides ⮕ Isocoumarins and derivatives

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  1. 2-(8-Hydroxy-6-methoxy-1-oxoisochromen-3-yl)propanoic acid
    2-(8-Hydroxy-6-methoxy-1-oxoisochromen-3-yl)propanoic acid
    CAS: 181427-78-1 Formula: C13H12O6 Molecular Weight: 264.23
    Out of Stock Item #: H1348034
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    Technical Identifiers
    IUPAC Name
    2-(8-hydroxy-6-methoxy-1-oxoisochromen-3-yl)propanoic acid
    SMILES
    CC(C1=CC2=CC(=CC(=C2C(=O)O1)O)OC)C(=O)O
    InChIKey
    BPZCXUROMKDLGX-UHFFFAOYSA-N
    InChI
    1S/C13H12O6/c1-6(12(15)16)10-4-7-3-8(18-2)5-9(14)11(7)13(17)19-10/h3-6,14H,1-2H3,(H,15,16)
  2. 1H-2-Benzopyran-1-one
    1H-2-Benzopyran-1-one
    CAS: 491-31-6 PubChem CID: 68108 Formula: C9H6O2 Molecular Weight: 146.14
    Solid ≥97%
    In Stock Item #: H694218
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    Technical Identifiers
    IUPAC Name
    isochromen-1-one
    SMILES
    C1=CC=C2C(=C1)C=COC2=O
    InChIKey
    IQZZFVDIZRWADY-UHFFFAOYSA-N
    InChI
    1S/C9H6O2/c10-9-8-4-2-1-3-7(8)5-6-11-9/h1-6H
  3. Brevifolincarboxylic acid
    Brevifolincarboxylic acid
    CAS: 18490-95-4 PubChem CID: 9838995 Formula: C13H8O8 Molecular Weight: 292.20
    ≥99%
    Out of Stock Item #: B648575
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    Technical Identifiers
    IUPAC Name
    7,8,9-trihydroxy-3,5-dioxo-1,2-dihydrocyclopenta[c]isochromene-1-carboxylic acid
    SMILES
    C1C(C2=C(C1=O)OC(=O)C3=CC(=C(C(=C32)O)O)O)C(=O)O
    InChIKey
    JFJWMFPFMLRLMI-UHFFFAOYSA-N
    InChI
    1S/C13H8O8/c14-5-2-4-7(10(17)9(5)16)8-3(12(18)19)1-6(15)11(8)21-13(4)20/h2-3,14,16-17H,1H2,(H,18,19)
  4. 6,8-Dihydroxy-3-methylisocoumarin
    6,8-Dihydroxy-3-methylisocoumarin
    CAS: 1204-37-1 Formula: C10H8O4 Molecular Weight: 192.17
    ≥95%(LC/MS-UV)
    Out of Stock Item #: D463939
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    Technical Identifiers
    IUPAC Name
    6,8-dihydroxy-3-methylisochromen-1-one
    SMILES
    CC1=CC2=CC(=CC(=C2C(=O)O1)O)O
    InChIKey
    OHHKDUWFPNAEHQ-UHFFFAOYSA-N
    InChI
    1S/C10H8O4/c1-5-2-6-3-7(11)4-8(12)9(6)10(13)14-5/h2-4,11-12H,1H3
    Synonyms
    BDBM50485548 | Q27105447 | C03830 | AC1NQXBQ | 1H-2-benzopyran-1-one, 6,8-dihydroxy-3-methyl- | 6,8-dihydroxy-3-methy...
  5. JCP174
    JCP174
    CAS: 126062-19-9 Formula: C12H12ClNO3 Molecular Weight: 253.68
    ≥98%
    In Stock Item #: J412955
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    Technical Identifiers
    IUPAC Name
    7-amino-4-chloro-3-propoxyisochromen-1-one
    SMILES
    CCCOC1=C(C2=C(C=C(C=C2)N)C(=O)O1)Cl
    InChIKey
    MDOWUFTZOHGGHU-UHFFFAOYSA-N
    InChI
    1S/C12H12ClNO3/c1-2-5-16-12-10(13)8-4-3-7(14)6-9(8)11(15)17-12/h3-4,6H,2,5,14H2,1H3
  6. Galloflavin
    Galloflavin
    CAS: 568-80-9 Formula: C12H6O8 Molecular Weight: 278.17
    2mM in DMSO
    In Stock Item #: G424805
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    Pricing & Pack Sizes
    Technical Identifiers
    IUPAC Name
    2,3,9,10-tetrahydroxypyrano[3,2-c]isochromene-6,8-dione
    SMILES
    C1=C2C(=C3C(=CC(=C(O3)O)O)OC2=O)C(=C(C1=O)O)O
    InChIKey
    UXHISTVMLJLECY-UHFFFAOYSA-N
    InChI
    1S/C12H6O8/c13-4-1-3-7(9(16)8(4)15)10-6(19-11(3)17)2-5(14)12(18)20-10/h1-2,14-16,18H
    Synonyms
    MLS000737267 | 6,8,9,10-tetrahydroxypyrano[3,2-c]isochromene-2,3-dione | FD10492 | DTXSID80205354 | 3,8,9,10-tetrahyd...
  7. 1,4,5,8-Naphthalenetetracarboxylic dianhydride(NTDA) - ≥96% CAS No(81-30-1) by Aladdin Scientific
    1,4,5,8-Naphthalenetetracarboxylic dianhydride(NTDA)
    CAS: 81-30-1 EC Number: 201-342-5 Formula: C14H4O6 Molecular Weight: 268.18
    Solid ≥96%
    In Stock Item #: N107577
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    Technical Identifiers
    IUPAC Name
    6,13-dioxatetracyclo[6.6.2.04,16.011,15]hexadeca-1(15),2,4(16),8,10-pentaene-5,7,12,14-tetrone
    SMILES
    C1=CC2=C3C(=CC=C4C3=C1C(=O)OC4=O)C(=O)OC2=O
    InChIKey
    YTVNOVQHSGMMOV-UHFFFAOYSA-N
    InChI
    1S/C14H4O6/c15-11-5-1-2-6-10-8(14(18)20-12(6)16)4-3-7(9(5)10)13(17)19-11/h1-4H
    Synonyms
    NTCDA | AKOS003614689 | 1,8:4, 5-Naphthalenetetracarboxylic dianhydride | Isochromeno[6,5,4-def]isochromene-1,3,6,8-t...
  8. 2,6-Dibromonaphthalene-1,4,5,8-tetracarboxylic Dianhydride
    2,6-Dibromonaphthalene-1,4,5,8-tetracarboxylic Dianhydride
    CAS: 83204-68-6 Formula: C14H2Br2O6 Molecular Weight: 425.97
    Solid ≥95%
    In Stock Item #: D155087
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    Technical Identifiers
    IUPAC Name
    2,9-dibromo-6,13-dioxatetracyclo[6.6.2.04,16.011,15]hexadeca-1,3,8,10,15-pentaene-5,7,12,14-tetrone
    SMILES
    C1=C2C3=C4C(=CC(=C3C(=O)OC2=O)Br)C(=O)OC(=O)C4=C1Br
    InChIKey
    FEDCHNPLDKDTNS-UHFFFAOYSA-N
    InChI
    1S/C14H2Br2O6/c15-5-1-3-7-8-4(12(18)22-13(19)9(5)8)2-6(16)10(7)14(20)21-11(3)17/h1-2H
    Synonyms
    MFCD00406909 | 2,9-dibromo-6,13-dioxatetracyclo[6.6.2.04,16.011,15]hexadeca-1,3,8,10,15-pentaene-5,7,12,14-tetrone | ...
  9. JLK 6 - Moligand™, ≥99%(HPLC) CAS No(62252-26-0) by Aladdin Scientific
    JLK 6
    CAS: 62252-26-0 Formula: C10H8ClNO3 Molecular Weight: 225.63
    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%(HPLC)
    In Stock Item #: J288072
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    Technical Identifiers
    IUPAC Name
    7-amino-4-chloro-3-methoxyisochromen-1-one
    SMILES
    COC1=C(C2=C(C=C(C=C2)N)C(=O)O1)Cl
    InChIKey
    AMDGKLWVCUXONP-UHFFFAOYSA-N
    InChI
    1S/C10H8ClNO3/c1-14-10-8(11)6-3-2-5(12)4-7(6)9(13)15-10/h2-4H,12H2,1H3
    Synonyms
    7-Amino-4-chloro-3-methoxy-1H-2-benzopyran | 7-Amino-4-chloro-3-methoxyisocoumarin
  10. Galloflavin
    Galloflavin
    CAS: 568-80-9 Formula: C12H6O8 Molecular Weight: 278.17
    Moligand™ ? Moligand™ — Aladdin's line of ligands and bioactive small molecules. Use for receptor, pathway, and binding studies needing defined small-molecule tools. ≥95%(HPLC)
    In Stock Item #: G133921
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    Technical Identifiers
    IUPAC Name
    2,3,9,10-tetrahydroxypyrano[3,2-c]isochromene-6,8-dione
    SMILES
    C1=C2C(=C3C(=CC(=C(O3)O)O)OC2=O)C(=C(C1=O)O)O
    InChIKey
    UXHISTVMLJLECY-UHFFFAOYSA-N
    InChI
    1S/C12H6O8/c13-4-1-3-7(9(16)8(4)15)10-6(19-11(3)17)2-5(14)12(18)20-10/h1-2,14-16,18H
    Synonyms
    MLS000737267 | 6,8,9,10-tetrahydroxypyrano[3,2-c]isochromene-2,3-dione | FD10492 | DTXSID80205354 | 3,8,9,10-tetrahyd...
  11. Reticulol
    Reticulol
    CAS: 26246-41-3 PubChem CID: 5359036 Formula: C11H10O5 Molecular Weight: 222.19
    ≥98%
    Out of Stock Item #: R275602
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    Technical Identifiers
    IUPAC Name
    6,8-dihydroxy-7-methoxy-3-methylisochromen-1-one
    SMILES
    CC1=CC2=CC(=C(C(=C2C(=O)O1)O)OC)O
    InChIKey
    LREZRXWUEZCZRU-UHFFFAOYSA-N
    InChI
    1S/C11H10O5/c1-5-3-6-4-7(12)10(15-2)9(13)8(6)11(14)16-5/h3-4,12-13H,1-2H3
    Synonyms
    HB4057 | NSC 294978 | 6,8-Dihydroxy-7-methoxy-3-methylisocoumarin | HY-120241 | K-251-1 | NSC294978 | NSC-294978 | 6,...
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