Flavaglines

Description:

Heterocyclic compounds with a structure characterized by a cyclopenta[b]benzofuran skeleton.

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  1. Aglafoline
    CAS: 143901-35-3 PubChem CID: 393601 Formula: C28H28O8 Molecular Weight: 492.5
    Out of Stock Item #: A697604
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    Technical Identifiers
    IUPAC Name
    methyl (1R,2R,3S,3aR,8bS)-1,8b-dihydroxy-6,8-dimethoxy-3a-(4-methoxyphenyl)-3-phenyl-2,3-dihydro-1H-cyclopenta[b][1]benzofuran-2-carboxylate
    SMILES
    COC1=CC=C(C=C1)C23C(C(C(C2(C4=C(O3)C=C(C=C4OC)OC)O)O)C(=O)OC)C5=CC=CC=C5
    InChIKey
    VFTGDXPPYSWBSO-GWNOIRNCSA-N
    InChI
    1S/C28H28O8/c1-32-18-12-10-17(11-13-18)28-23(16-8-6-5-7-9-16)22(26(30)35-4)25(29)27(28,31)24-20(34-3)14-19(33-2)15-21(24)36-28/h5-15,22-23,25,29,31H,1show more
  2. Silvestrol aglycone
    CAS: 960365-65-5 PubChem CID: 24178739 Formula: C27H26O8 Molecular Weight: 478.49
    Out of Stock Item #: S648945
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    Technical Identifiers
    SMILES
    COC1=CC=C(C=C1)[C@]23[C@@H]([C@H]([C@H]([C@]2(C4=C(O3)C=C(C=C4OC)O)O)O)C(=O)OC)C5=CC=CC=C5
  3. CR-1-31-B
    CAS: 1352914-52-3 PubChem CID: 56946209 Formula: C28H29NO8 Molecular Weight: 507.53
    Out of Stock Item #: C649533
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    Technical Identifiers
    IUPAC Name
    (1R,2R,3S,3aR,8bS)-1,8b-dihydroxy-N,6,8-trimethoxy-3a-(4-methoxyphenyl)-3-phenyl-2,3-dihydro-1H-cyclopenta[b][1]benzofuran-2-carboxamide
    SMILES
    COC1=CC=C(C=C1)C23C(C(C(C2(C4=C(O3)C=C(C=C4OC)OC)O)O)C(=O)NOC)C5=CC=CC=C5
    InChIKey
    KLSIFOJPWJBRFH-GWNOIRNCSA-N
    InChI
    1S/C28H29NO8/c1-33-18-12-10-17(11-13-18)28-23(16-8-6-5-7-9-16)22(26(31)29-36-4)25(30)27(28,32)24-20(35-3)14-19(34-2)15-21(24)37-28/h5-15,22-23,25,30,3show more
  4. Didesmethylrocaglamide
    CAS: 177262-30-5 PubChem CID: 397614 Formula: C27H27NO7 Molecular Weight: 477.51
    Out of Stock Item #: D646145
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    Technical Identifiers
    IUPAC Name
    (1R,2R,3S,3aR,8bS)-1,8b-dihydroxy-6,8-dimethoxy-3a-(4-methoxyphenyl)-3-phenyl-2,3-dihydro-1H-cyclopenta[b][1]benzofuran-2-carboxamide
    SMILES
    COC1=CC=C(C=C1)C23C(C(C(C2(C4=C(O3)C=C(C=C4OC)OC)O)O)C(=O)N)C5=CC=CC=C5
    InChIKey
    RMNPQEWLGQURNX-PXIJUOARSA-N
    InChI
    1S/C27H27NO7/c1-32-17-11-9-16(10-12-17)27-22(15-7-5-4-6-8-15)21(25(28)30)24(29)26(27,31)23-19(34-3)13-18(33-2)14-20(23)35-27/h4-14,21-22,24,29,31H,1-3show more
  5. Silvestrol
    CAS: 697235-38-4 Formula: C34H38O13 Molecular Weight: 654.66
    Out of Stock Item #: S126127
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    Technical Identifiers
    IUPAC Name
    methyl (1R,2R,3S,3aR,8bS)-6-[[(2S,3R,6R)-6-[(1R)-1,2-dihydroxyethyl]-3-methoxy-1,4-dioxan-2-yl]oxy]-1,8b-dihydroxy-8-methoxy-3a-(4-methoxyphenyl)-3-phshow more
    SMILES
    COC1C(OC(CO1)C(CO)O)OC2=CC3=C(C(=C2)OC)C4(C(C(C(C4(O3)C5=CC=C(C=C5)OC)C6=CC=CC=C6)C(=O)OC)O)O
    InChIKey
    GVKXFVCXBFGBCD-QKDMMWSPSA-N
    InChI
    1S/C34H38O13/c1-40-20-12-10-19(11-13-20)34-27(18-8-6-5-7-9-18)26(30(38)42-3)29(37)33(34,39)28-23(41-2)14-21(15-24(28)47-34)45-32-31(43-4)44-17-25(46-3show more
    Synonyms
    1H-Cyclopenta(b)benzofuran-2-carboxylic acid, 6-(((2S,3R,6R)-6-((1R)-1,2-dihydroxyethyl)-3-methoxy-1,4-dioxan-2-yl)ox...
  6. Episilvestrol
    CAS: 697235-39-5 Formula: C34H38O13 Molecular Weight: 654.66
    Out of Stock Item #: E126128
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    Technical Identifiers
    IUPAC Name
    methyl (1R,2R,3S,3aR,8bS)-6-[[(2S,3R,6R)-6-[(1S)-1,2-dihydroxyethyl]-3-methoxy-1,4-dioxan-2-yl]oxy]-1,8b-dihydroxy-8-methoxy-3a-(4-methoxyphenyl)-3-phshow more
    SMILES
    COC1C(OC(CO1)C(CO)O)OC2=CC3=C(C(=C2)OC)C4(C(C(C(C4(O3)C5=CC=C(C=C5)OC)C6=CC=CC=C6)C(=O)OC)O)O
    InChIKey
    GVKXFVCXBFGBCD-JRPGFILLSA-N
    InChI
    1S/C34H38O13/c1-40-20-12-10-19(11-13-20)34-27(18-8-6-5-7-9-18)26(30(38)42-3)29(37)33(34,39)28-23(41-2)14-21(15-24(28)47-34)45-32-31(43-4)44-17-25(46-3show more
    Synonyms
    DTXSID80466766 | CHEBI:66485 | Episilvestrol | epi-silvestrol | EX-A4881 | MS-30981 | HY-15359 | methyl (1R,2R,3S,3aR...
  7. Rocaglamide
    CAS: 84573-16-0 PubChem CID: 331783 Formula: C29H31NO7 Molecular Weight: 505.57
    Out of Stock Item #: R276055
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    Technical Identifiers
    IUPAC Name
    (1R,2R,3S,3aR,8bS)-1,8b-dihydroxy-6,8-dimethoxy-3a-(4-methoxyphenyl)-N,N-dimethyl-3-phenyl-2,3-dihydro-1H-cyclopenta[b][1]benzofuran-2-carboxamide
    SMILES
    CN(C)C(=O)C1C(C2(C(C1O)(C3=C(O2)C=C(C=C3OC)OC)O)C4=CC=C(C=C4)OC)C5=CC=CC=C5
    InChIKey
    DAPAQENNNINUPW-IDAMAFBJSA-N
    InChI
    1S/C29H31NO7/c1-30(2)27(32)23-24(17-9-7-6-8-10-17)29(18-11-13-19(34-3)14-12-18)28(33,26(23)31)25-21(36-5)15-20(35-4)16-22(25)37-29/h6-16,23-24,26,31,3show more
    Synonyms
    FRG4N852F7 | B603847K064 | NSC326408 | Rocaglamide | 1H-Cyclopenta(b)benzofuran-2-carboxamide, 2,3,3a,8b-tetrahydro-1...
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