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Isoflav-2-enes

Description:

Flavonoids with a structure based on the 3-phenylchromene skeleton, with a double bond between the C2 and C3 carbon atoms of the chromene moiety.

Ancestors:

Organic compounds ⮕ Phenylpropanoids and polyketides ⮕ Isoflavonoids ⮕ Isoflav-2-enes
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Items 13-24 of 46

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  1. KIN101
      Grade & Purity: 
    • ≥99%
    Cas Number: 610753-87-2        Compound CID:  1998840
    Formula:  C16H11BrO5S        Molecular Weight: 395.22
    IUPAC Name:  [3-(4-bromophenyl)-4-oxochromen-7-yl] methanesulfonate
    SMILES:  CS(=O)(=O)OC1=CC2=C(C=C1)C(=O)C(=CO2)C3=CC=C(C=C3)Br
    InChIKey: SJGDYHHAYHRLNC-UHFFFAOYSA-N
    InChI:  InChI=1S/C16H11BrO5S/c1-23(19,20)22-12-6-7-13-15(8-12)21-9-14(16(13)18)10-2-4-11(17)5-3-10/h2-9H,1H3
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  2. Glicoricone
      Grade & Purity: 
    • ≥96%
    Cas Number: 161099-37-2        Compound CID:  10361658
    Formula:  C21H20O6        Molecular Weight: 368.38
    IUPAC Name:  3-[4,6-dihydroxy-2-methoxy-3-(3-methylbut-2-enyl)phenyl]-7-hydroxychromen-4-one
    SMILES:  CC(=CCC1=C(C(=C(C=C1O)O)C2=COC3=C(C2=O)C=CC(=C3)O)OC)C
    InChIKey: SSDIPYMSXRNGMZ-UHFFFAOYSA-N
    InChI:  InChI=1S/C21H20O6/c1-11(2)4-6-13-16(23)9-17(24)19(21(13)26-3)15-10-27-18-8-12(22)5-7-14(18)20(15)25/h4-5,7-10,22-24H,6H2,1-3H3
    Synonyms: 3-[4,6-dihydroxy-2-methoxy-3-(3-methylbut-2-en-1-yl)phenyl]-7-hydroxy-4H-chromen-4-one | DTXSID401121041 | CHEBI:1757...
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  3. Tenalisib R Enantiomer
      Grade & Purity: 
    • ≥98%
    Cas Number: 1639417-54-1        Compound CID:  117729511
    Formula:  C23H18FN5O2        Molecular Weight: 415.42
    IUPAC Name:  3-(3-fluorophenyl)-2-[(1R)-1-(7H-purin-6-ylamino)propyl]chromen-4-one
    SMILES:  CCC(C1=C(C(=O)C2=CC=CC=C2O1)C3=CC(=CC=C3)F)NC4=NC=NC5=C4NC=N5
    InChIKey: HDXDQPRPFRKGKZ-MRXNPFEDSA-N
    InChI:  InChI=1S/C23H18FN5O2/c1-2-16(29-23-19-22(26-11-25-19)27-12-28-23)21-18(13-6-5-7-14(24)10-13)20(30)15-8-3-4-9-17(15)31-21/h3-12,16H,2H2,1H3,(H2,25,26,2show more
    Synonyms: 1639417-54-1 | HY-112172 | MS-27201 | SCHEMBL16279824 | DTXSID001138191 | AKOS040740197 | RP6530 R Enantiomer | 3-(3-...
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  4. Corylifol A
      Grade & Purity: 
    • ≥99%
    Cas Number: 775351-88-7        Compound CID:  25056407
    Formula:  C25H26O4        Molecular Weight: 390.47
    IUPAC Name:  3-[3-[(2E)-3,7-dimethylocta-2,6-dienyl]-4-hydroxyphenyl]-7-hydroxychromen-4-one
    SMILES:  CC(=CCCC(=CCC1=C(C=CC(=C1)C2=COC3=C(C2=O)C=CC(=C3)O)O)C)C
    InChIKey: ZBHUUXLHDOUMKM-REZTVBANSA-N
    InChI:  InChI=1S/C25H26O4/c1-16(2)5-4-6-17(3)7-8-19-13-18(9-12-23(19)27)22-15-29-24-14-20(26)10-11-21(24)25(22)28/h5,7,9-15,26-27H,4,6,8H2,1-3H3/b17-7+
    Synonyms: AKOS032948982 | MS-26509 | 3-[3-[(2E)-3,7-dimethylocta-2,6-dienyl]-4-hydroxyphenyl]-7-hydroxychromen-4-one | Corylini...
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  5. Umbralisib hydrochloride
      Grade & Purity: 
    • ≥98%
    Cas Number: 1532533-78-0        Compound CID:  90030289
    Formula:  C31H25ClF3N5O3        Molecular Weight: 608.01
    IUPAC Name:  2-[(1S)-1-[4-amino-3-(3-fluoro-4-propan-2-yloxyphenyl)pyrazolo[3,4-d]pyrimidin-1-yl]ethyl]-6-fluoro-3-(3-fluorophenyl)chromen-4-one;hydrochloride
    SMILES:  CC(C)OC1=C(C=C(C=C1)C2=NN(C3=NC=NC(=C23)N)C(C)C4=C(C(=O)C5=C(O4)C=CC(=C5)F)C6=CC(=CC=C6)F)F.Cl
    InChIKey: QGVUVMVWYWMZIR-NTISSMGPSA-N
    InChI:  InChI=1S/C31H24F3N5O3.ClH/c1-15(2)41-24-9-7-18(12-22(24)34)27-26-30(35)36-14-37-31(26)39(38-27)16(3)29-25(17-5-4-6-19(32)11-17)28(40)21-13-20(33)8-10-show more
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  6. Orobol
      Grade & Purity: 
    • ≥99%
    Cas Number: 480-23-9        Compound CID:  5281801
    Formula:  C15H10O6        Molecular Weight: 286.24
    IUPAC Name:  3-(3,4-dihydroxyphenyl)-5,7-dihydroxychromen-4-one
    SMILES:  C1=CC(=C(C=C1C2=COC3=CC(=CC(=C3C2=O)O)O)O)O
    InChIKey: IOYHCQBYQJQBSK-UHFFFAOYSA-N
    InChI:  InChI=1S/C15H10O6/c16-8-4-12(19)14-13(5-8)21-6-9(15(14)20)7-1-2-10(17)11(18)3-7/h1-6,16-19H
    Synonyms: Q7103718 | 3'-hydroxygenistein | 3'-hydroxy-genistein | 3-(3,4-dihydroxyphenyl)-5,7-dihydroxy-chromen-4-one | 4H-1-Be...
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  7. tectorigenin
    IUPAC Name:  5,7-dihydroxy-3-(4-hydroxyphenyl)-6-methoxychromen-4-one
    SMILES:  COc1c(O)cc2c(c1O)c(=O)c(co2)c1ccc(cc1)O
    InChIKey: OBBCRPUNCUPUOS-UHFFFAOYSA-N
    InChI:  InChI=1S/C16H12O6/c1-21-16-11(18)6-12-13(15(16)20)14(19)10(7-22-12)8-2-4-9(17)5-3-8/h2-7,17-18,20H,1H3
    Synonyms: HY-N0792 | DTXSID50203286 | FT-0688353 | K 251T | KBioSS_001241 | Tectorigenin | Tectorigenine | 3-(4-hydroxyphenyl)-...
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  8. NCRW0105-E06
    Cas Number: 302953-04-4        Compound CID:  5348723
    IUPAC Name:  3-(4-chlorophenyl)-7-hydroxy-2-(trifluoromethyl)chromen-4-one
    SMILES:  Oc1cc2c(cc1)c(=O)c(c1ccc(Cl)cc1)c(o2)C(F)(F)F
    InChIKey: LIVWZNRIYNUFRC-UHFFFAOYSA-N
    InChI:  InChI=1S/C16H8ClF3O3/c17-9-3-1-8(2-4-9)13-14(22)11-6-5-10(21)7-12(11)23-15(13)16(18,19)20/h1-7,21H
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  9. irigenol
    IUPAC Name:  5,6,7-trihydroxy-3-(3,4,5-trihydroxyphenyl)chromen-4-one
    SMILES:  Oc1cc(cc(c1O)O)c1coc2c(c1=O)c(O)c(c(c2)O)O
    InChIKey: DFURNQJNFBMYHM-UHFFFAOYSA-N
    InChI:  InChI=1S/C15H10O8/c16-7-1-5(2-8(17)13(7)20)6-4-23-10-3-9(18)14(21)15(22)11(10)12(6)19/h1-4,16-18,20-22H
    Synonyms: compound 4
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  10. Isoprunetin
      Grade & Purity: 
    • ≥95%(LC/MS-ELSD)
    Cas Number: 4569-98-6
    Formula:  C16H12O5        Molecular Weight: 284.26
    IUPAC Name:  7-hydroxy-3-(4-hydroxyphenyl)-5-methoxychromen-4-one
    SMILES:  COC1=CC(=CC2=C1C(=O)C(=CO2)C3=CC=C(C=C3)O)O
    InChIKey: YSINCDVRUMTOPK-UHFFFAOYSA-N
    InChI:  InChI=1S/C16H12O5/c1-20-13-6-11(18)7-14-15(13)16(19)12(8-21-14)9-2-4-10(17)5-3-9/h2-8,17-18H,1H3
    Synonyms: 7-Hydroxy-3-(4-hydroxyphenyl)-5-methoxy-4H-chromen-4-one | ISOFLAVONE, 4',7-DIHYDROXY-5-METHOXY- | 7-Hydroxy-3-(4-hyd...
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  11. Neobavaisoflavone
      Grade & Purity: 
    • 10mM in DMSO
    Cas Number: 41060-15-5(DMSO)
    Formula:  C20H18O4        Molecular Weight: 322.35
    IUPAC Name:  7-hydroxy-3-[4-hydroxy-3-(3-methylbut-2-enyl)phenyl]chromen-4-one
    SMILES:  CC(=CCC1=C(C=CC(=C1)C2=COC3=C(C2=O)C=CC(=C3)O)O)C
    InChIKey: OBGPEBYHGIUFBN-UHFFFAOYSA-N
    InChI:  InChI=1S/C20H18O4/c1-12(2)3-4-14-9-13(5-8-18(14)22)17-11-24-19-10-15(21)6-7-16(19)20(17)23/h3,5-11,21-22H,4H2,1-2H3
    Synonyms: Neobavaisoflavone|41060-15-5|3'-Prenyldaidzein|7-hydroxy-3-[4-hydroxy-3-(3-methylbut-2-enyl)phenyl]chromen-4-one|CHEB...
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  12. umbralisib (TGR-1202)
    Cas Number: 1532533-67-7        Compound CID:  72950888
    Formula:  C31H24F3N5O3        Molecular Weight: 571.55
    IUPAC Name:  2-[(1S)-1-[4-amino-3-(3-fluoro-4-propan-2-yloxyphenyl)pyrazolo[3,4-d]pyrimidin-1-yl]ethyl]-6-fluoro-3-(3-fluorophenyl)chromen-4-one
    SMILES:  CC(C)OC1=C(C=C(C=C1)C2=NN(C3=NC=NC(=C23)N)C(C)C4=C(C(=O)C5=C(O4)C=CC(=C5)F)C6=CC(=CC=C6)F)F
    InChIKey: IUVCFHHAEHNCFT-INIZCTEOSA-N
    InChI:  InChI=1S/C31H24F3N5O3/c1-15(2)41-24-9-7-18(12-22(24)34)27-26-30(35)36-14-37-31(26)39(38-27)16(3)29-25(17-5-4-6-19(32)11-17)28(40)21-13-20(33)8-10-23(2show more
    Synonyms: Umbralisib|1532533-67-7|TGR-1202|rp-5264|TGR1202|TGR-1202 free base|RP5264|Umbralisib [USAN]|(S)-2-(1-(4-amino-3-(3-f...
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