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Isoflavone

Organische Verbindungen, die Isomere von Flavonoiden mit einer 3-Phenylchromen-4-Eins-Struktur sind; auch Phytoöstrogene genannt.

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1

3'-Hydroxypuerarin, TRC

CAS: 117060-54-5 Summenformel: C21 H20 O10 Molekulargewicht (g/mol): 432.38 Synonym: 4H-1-Benzopyran-4-one, 3-(3,4-dihydroxyphenyl)-8-β-D-glucopyranosyl-7-hydroxy-,3-(3,4-Dihydroxyphenyl)-8-β-D-glucopyranosyl-7-hydroxy-4H-1-benzopyran-4-one,3'-Hydroxypuerarin,8-C-Glucosyl-7,3',4'-trihydroxyisoflavone,NPI 031H,PG 1 IUPAC-Name: 3-(3,4-dihydroxyphenyl)-7-hydroxy-8-[(2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]chromen-4-one SMILES: OC[C@H]1O[C@H]([C@H](O)[C@@H](O)[C@@H]1O)c2c(O)ccc3C(=O)C(=COc23)c4ccc(O)c(O)c4

IUPAC-Name 3-(3,4-dihydroxyphenyl)-7-hydroxy-8-[(2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]chromen-4-one
CAS 117060-54-5
Molekulargewicht (g/mol) 432.38
SMILES OC[C@H]1O[C@H]([C@H](O)[C@@H](O)[C@@H]1O)c2c(O)ccc3C(=O)C(=COc23)c4ccc(O)c(O)c4
Synonym 4H-1-Benzopyran-4-one, 3-(3,4-dihydroxyphenyl)-8-β-D-glucopyranosyl-7-hydroxy-,3-(3,4-Dihydroxyphenyl)-8-β-D-glucopyranosyl-7-hydroxy-4H-1-benzopyran-4-one,3'-Hydroxypuerarin,8-C-Glucosyl-7,3',4'-trihydroxyisoflavone,NPI 031H,PG 1
Summenformel C21 H20 O10
2
Sonderaktionen verfügbar

Daidzein, 98 %, Thermo Scientific Chemicals

CAS: 486-66-8 Summenformel: C15H10O4 Molekulargewicht (g/mol): 254.24 MDL-Nummer: MFCD00016954 InChI-Schlüssel: ZQSIJRDFPHDXIC-UHFFFAOYSA-N Synonym: daidzein,4',7-dihydroxyisoflavone,daidzeol,7,4'-dihydroxyisoflavone,7-hydroxy-3-4-hydroxyphenyl-4h-chromen-4-one,diadzein,7-hydroxy-3-4-hydroxyphenyl-4h-1-benzopyran-4-one,4h-1-benzopyran-4-one, 7-hydroxy-3-4-hydroxyphenyl,7-hydroxy-3-4-hydroxyphenyl chromen-4-one,7-hydroxy-3-4-hydroxyphenyl-4-benzopyrone PubChem CID: 5281708 ChEBI: CHEBI:28197 IUPAC-Name: 7-Hydroxy-3-(4-hydroxyphenyl)chromen-4-on SMILES: C1=CC(=CC=C1C2=COC3=C(C2=O)C=CC(=C3)O)O

InChI-Schlüssel ZQSIJRDFPHDXIC-UHFFFAOYSA-N
IUPAC-Name 7-Hydroxy-3-(4-hydroxyphenyl)chromen-4-on
PubChem CID 5281708
CAS 486-66-8
ChEBI CHEBI:28197
MDL-Nummer MFCD00016954
Molekulargewicht (g/mol) 254.24
SMILES C1=CC(=CC=C1C2=COC3=C(C2=O)C=CC(=C3)O)O
Synonym daidzein,4',7-dihydroxyisoflavone,daidzeol,7,4'-dihydroxyisoflavone,7-hydroxy-3-4-hydroxyphenyl-4h-chromen-4-one,diadzein,7-hydroxy-3-4-hydroxyphenyl-4h-1-benzopyran-4-one,4h-1-benzopyran-4-one, 7-hydroxy-3-4-hydroxyphenyl,7-hydroxy-3-4-hydroxyphenyl chromen-4-one,7-hydroxy-3-4-hydroxyphenyl-4-benzopyrone
Summenformel C15H10O4
3

(+/-)-Equol, Thermo Scientific Chemicals

CAS: 94105-90-5 Summenformel: Gehäuse C15H14O3 Molekulargewicht (g/mol): 242.27 MDL-Nummer: MFCD00016662 InChI-Schlüssel: ADFCQWZHKCXPAJ-UHFFFAOYNA-N Synonym: 3-4-hydroxyphenyl chroman-7-ol,equol,+/--equol,r,s-equol,7,4'-homoisoflavane,4',7-dihydroxyisoflavane,rs-equol,3-4-hydroxyphenyl-7-chromanol,2h-1-benzopyran-7-ol, 3,4-dihydro-3-4-hydroxyphenyl,4',7-isoflavandiol PubChem CID: 382975 IUPAC-Name: 3-(4-Hydroxyphenyl)-3,4-dihydro-2H-chromen-7-ol SMILES: OC1=CC=C(C=C1)C1COC2=C(C1)C=CC(O)=C2

InChI-Schlüssel ADFCQWZHKCXPAJ-UHFFFAOYNA-N
IUPAC-Name 3-(4-Hydroxyphenyl)-3,4-dihydro-2H-chromen-7-ol
PubChem CID 382975
CAS 94105-90-5
MDL-Nummer MFCD00016662
Molekulargewicht (g/mol) 242.27
SMILES OC1=CC=C(C=C1)C1COC2=C(C1)C=CC(O)=C2
Synonym 3-4-hydroxyphenyl chroman-7-ol,equol,+/--equol,r,s-equol,7,4'-homoisoflavane,4',7-dihydroxyisoflavane,rs-equol,3-4-hydroxyphenyl-7-chromanol,2h-1-benzopyran-7-ol, 3,4-dihydro-3-4-hydroxyphenyl,4',7-isoflavandiol
Summenformel Gehäuse C15H14O3
4

4',7-Dihydroxyisoflavon, ≥ 98 %, Thermo Scientific Chemicals

CAS: 486-66-8 Summenformel: C15H10O4 Molekulargewicht (g/mol): 254.241 MDL-Nummer: MFCD00016954 InChI-Schlüssel: ZQSIJRDFPHDXIC-UHFFFAOYSA-N Synonym: daidzein,4',7-dihydroxyisoflavone,daidzeol,7,4'-dihydroxyisoflavone,7-hydroxy-3-4-hydroxyphenyl-4h-chromen-4-one,diadzein,7-hydroxy-3-4-hydroxyphenyl-4h-1-benzopyran-4-one,4h-1-benzopyran-4-one, 7-hydroxy-3-4-hydroxyphenyl,7-hydroxy-3-4-hydroxyphenyl chromen-4-one,7-hydroxy-3-4-hydroxyphenyl-4-benzopyrone PubChem CID: 5281708 ChEBI: CHEBI:28197 IUPAC-Name: 7-Hydroxy-3-(4-hydroxyphenyl)chromen-4-on SMILES: C1=CC(=CC=C1C2=COC3=C(C2=O)C=CC(=C3)O)O

InChI-Schlüssel ZQSIJRDFPHDXIC-UHFFFAOYSA-N
IUPAC-Name 7-Hydroxy-3-(4-hydroxyphenyl)chromen-4-on
PubChem CID 5281708
CAS 486-66-8
ChEBI CHEBI:28197
MDL-Nummer MFCD00016954
Molekulargewicht (g/mol) 254.241
SMILES C1=CC(=CC=C1C2=COC3=C(C2=O)C=CC(=C3)O)O
Synonym daidzein,4',7-dihydroxyisoflavone,daidzeol,7,4'-dihydroxyisoflavone,7-hydroxy-3-4-hydroxyphenyl-4h-chromen-4-one,diadzein,7-hydroxy-3-4-hydroxyphenyl-4h-1-benzopyran-4-one,4h-1-benzopyran-4-one, 7-hydroxy-3-4-hydroxyphenyl,7-hydroxy-3-4-hydroxyphenyl chromen-4-one,7-hydroxy-3-4-hydroxyphenyl-4-benzopyrone
Summenformel C15H10O4
5

4',7-Dihydroxyisoflavon, 97 %, Thermo Scientific Chemicals

CAS: 486-66-8 Summenformel: C15H10O4 Molekulargewicht (g/mol): 254.241 MDL-Nummer: MFCD00016954 InChI-Schlüssel: ZQSIJRDFPHDXIC-UHFFFAOYSA-N Synonym: daidzein,4',7-dihydroxyisoflavone,daidzeol,7,4'-dihydroxyisoflavone,7-hydroxy-3-4-hydroxyphenyl-4h-chromen-4-one,diadzein,7-hydroxy-3-4-hydroxyphenyl-4h-1-benzopyran-4-one,4h-1-benzopyran-4-one, 7-hydroxy-3-4-hydroxyphenyl,7-hydroxy-3-4-hydroxyphenyl chromen-4-one,7-hydroxy-3-4-hydroxyphenyl-4-benzopyrone PubChem CID: 5281708 ChEBI: CHEBI:28197 IUPAC-Name: 7-Hydroxy-3-(4-hydroxyphenyl)chromen-4-on SMILES: C1=CC(=CC=C1C2=COC3=C(C2=O)C=CC(=C3)O)O

InChI-Schlüssel ZQSIJRDFPHDXIC-UHFFFAOYSA-N
IUPAC-Name 7-Hydroxy-3-(4-hydroxyphenyl)chromen-4-on
PubChem CID 5281708
CAS 486-66-8
ChEBI CHEBI:28197
MDL-Nummer MFCD00016954
Molekulargewicht (g/mol) 254.241
SMILES C1=CC(=CC=C1C2=COC3=C(C2=O)C=CC(=C3)O)O
Synonym daidzein,4',7-dihydroxyisoflavone,daidzeol,7,4'-dihydroxyisoflavone,7-hydroxy-3-4-hydroxyphenyl-4h-chromen-4-one,diadzein,7-hydroxy-3-4-hydroxyphenyl-4h-1-benzopyran-4-one,4h-1-benzopyran-4-one, 7-hydroxy-3-4-hydroxyphenyl,7-hydroxy-3-4-hydroxyphenyl chromen-4-one,7-hydroxy-3-4-hydroxyphenyl-4-benzopyrone
Summenformel C15H10O4
7

5,7-Dihydroxy-4'-Methoxyisoflavon, 98 %, Thermo Scientific Chemicals

CAS: 491-80-5 Summenformel: C16H12O5 Molekulargewicht (g/mol): 284.27 MDL-Nummer: MFCD00006839 InChI-Schlüssel: WUADCCWRTIWANL-UHFFFAOYSA-N Synonym: biochanin a,biochanin,4'-methylgenistein,5,7-dihydroxy-4'-methoxyisoflavone,5,7-dihydroxy-3-4-methoxyphenyl-4h-chromen-4-one,genistein 4-methyl ether,pratensol,biochanine a,5,7-dihydrox-4'-methoxyisoflavone,4h-1-benzopyran-4-one, 5,7-dihydroxy-3-4-methoxyphenyl PubChem CID: 5280373 ChEBI: CHEBI:17574 IUPAC-Name: 5,7-dihydroxy-3-(4-methoxyphenyl)-4H-chromen-4-one SMILES: COC1=CC=C(C=C1)C1=COC2=CC(O)=CC(O)=C2C1=O

InChI-Schlüssel WUADCCWRTIWANL-UHFFFAOYSA-N
IUPAC-Name 5,7-dihydroxy-3-(4-methoxyphenyl)-4H-chromen-4-one
PubChem CID 5280373
CAS 491-80-5
ChEBI CHEBI:17574
MDL-Nummer MFCD00006839
Molekulargewicht (g/mol) 284.27
SMILES COC1=CC=C(C=C1)C1=COC2=CC(O)=CC(O)=C2C1=O
Synonym biochanin a,biochanin,4'-methylgenistein,5,7-dihydroxy-4'-methoxyisoflavone,5,7-dihydroxy-3-4-methoxyphenyl-4h-chromen-4-one,genistein 4-methyl ether,pratensol,biochanine a,5,7-dihydrox-4'-methoxyisoflavone,4h-1-benzopyran-4-one, 5,7-dihydroxy-3-4-methoxyphenyl
Summenformel C16H12O5
8

Daidzein, 98,7%, MP Biomedicals

CAS: 486-66-8 Summenformel: C15H10O4 Molekulargewicht (g/mol): 254.241 InChI-Schlüssel: ZQSIJRDFPHDXIC-UHFFFAOYSA-N Synonym: daidzein,4',7-dihydroxyisoflavone,daidzeol,7,4'-dihydroxyisoflavone,7-hydroxy-3-4-hydroxyphenyl-4h-chromen-4-one,diadzein,7-hydroxy-3-4-hydroxyphenyl-4h-1-benzopyran-4-one,4h-1-benzopyran-4-one, 7-hydroxy-3-4-hydroxyphenyl,7-hydroxy-3-4-hydroxyphenyl chromen-4-one,7-hydroxy-3-4-hydroxyphenyl-4-benzopyrone PubChem CID: 5281708 ChEBI: CHEBI:28197 IUPAC-Name: 7-Hydroxy-3-(4-hydroxyphenyl)chromen-4-on SMILES: C1=CC(=CC=C1C2=COC3=C(C2=O)C=CC(=C3)O)O

InChI-Schlüssel ZQSIJRDFPHDXIC-UHFFFAOYSA-N
IUPAC-Name 7-Hydroxy-3-(4-hydroxyphenyl)chromen-4-on
PubChem CID 5281708
CAS 486-66-8
ChEBI CHEBI:28197
Molekulargewicht (g/mol) 254.241
SMILES C1=CC(=CC=C1C2=COC3=C(C2=O)C=CC(=C3)O)O
Synonym daidzein,4',7-dihydroxyisoflavone,daidzeol,7,4'-dihydroxyisoflavone,7-hydroxy-3-4-hydroxyphenyl-4h-chromen-4-one,diadzein,7-hydroxy-3-4-hydroxyphenyl-4h-1-benzopyran-4-one,4h-1-benzopyran-4-one, 7-hydroxy-3-4-hydroxyphenyl,7-hydroxy-3-4-hydroxyphenyl chromen-4-one,7-hydroxy-3-4-hydroxyphenyl-4-benzopyrone
Summenformel C15H10O4
9

4',5,7-Trihydroxyisoflavon, ≥ 99 %, Thermo Scientific Chemicals

CAS: 446-72-0 Summenformel: C15H10O5 Molekulargewicht (g/mol): 270.24 MDL-Nummer: MFCD00016952 InChI-Schlüssel: TZBJGXHYKVUXJN-UHFFFAOYSA-N Synonym: genistein,prunetol,genisteol,4',5,7-trihydroxyisoflavone,genisterin,sophoricol,5,7,4'-trihydroxyisoflavone,bonistein,5,7-dihydroxy-3-4-hydroxyphenyl-4h-chromen-4-one,genestein PubChem CID: 5280961 ChEBI: CHEBI:28088 IUPAC-Name: 5,7-Dihydroxy-3-(4-hydroxyphenyl)chromen-4-on SMILES: OC1=CC=C(C=C1)C1=COC2=CC(O)=CC(O)=C2C1=O

InChI-Schlüssel TZBJGXHYKVUXJN-UHFFFAOYSA-N
IUPAC-Name 5,7-Dihydroxy-3-(4-hydroxyphenyl)chromen-4-on
PubChem CID 5280961
CAS 446-72-0
ChEBI CHEBI:28088
MDL-Nummer MFCD00016952
Molekulargewicht (g/mol) 270.24
SMILES OC1=CC=C(C=C1)C1=COC2=CC(O)=CC(O)=C2C1=O
Synonym genistein,prunetol,genisteol,4',5,7-trihydroxyisoflavone,genisterin,sophoricol,5,7,4'-trihydroxyisoflavone,bonistein,5,7-dihydroxy-3-4-hydroxyphenyl-4h-chromen-4-one,genestein
Summenformel C15H10O5
10
Sonderaktionen verfügbar

Daidzin, 98 %, Thermo Scientific Chemicals

CAS: 552-66-9 Summenformel: C21H20O9 Molekulargewicht (g/mol): 416.38 MDL-Nummer: MFCD00017466 InChI-Schlüssel: KYQZWONCHDNPDP-QNDFHXLGSA-N Synonym: daidzin,daidzoside,daidzein 7-o-glucoside,daidzein 7-glucoside,daidzein-7-glucoside,daidzein 7-o-beta-d-glucoside,unii-4r2x91a5m5,daidzein-7-o-glucoside,7-beta-d-glucopyranosyloxy-3-4-hydroxyphenyl-4h-1-benzopyran-4-one,7-o-b-d-glucopyranoside PubChem CID: 107971 ChEBI: CHEBI:42202 IUPAC-Name: 3-(4-Hydroxyphenyl)-7-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-on SMILES: OC[C@H]1O[C@@H](OC2=CC=C3C(=O)C(=COC3=C2)C2=CC=C(O)C=C2)[C@H](O)[C@@H](O)[C@@H]1O

InChI-Schlüssel KYQZWONCHDNPDP-QNDFHXLGSA-N
IUPAC-Name 3-(4-Hydroxyphenyl)-7-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-on
PubChem CID 107971
CAS 552-66-9
ChEBI CHEBI:42202
MDL-Nummer MFCD00017466
Molekulargewicht (g/mol) 416.38
SMILES OC[C@H]1O[C@@H](OC2=CC=C3C(=O)C(=COC3=C2)C2=CC=C(O)C=C2)[C@H](O)[C@@H](O)[C@@H]1O
Synonym daidzin,daidzoside,daidzein 7-o-glucoside,daidzein 7-glucoside,daidzein-7-glucoside,daidzein 7-o-beta-d-glucoside,unii-4r2x91a5m5,daidzein-7-o-glucoside,7-beta-d-glucopyranosyloxy-3-4-hydroxyphenyl-4h-1-benzopyran-4-one,7-o-b-d-glucopyranoside
Summenformel C21H20O9
11
Sonderaktionen verfügbar

Genistein, 99 %, synthetisch, Thermo Scientific Chemicals

CAS: 446-72-0 Summenformel: C15H10O5 Molekulargewicht (g/mol): 270.24 MDL-Nummer: MFCD00016952 InChI-Schlüssel: TZBJGXHYKVUXJN-UHFFFAOYSA-N Synonym: genistein,prunetol,genisteol,4',5,7-trihydroxyisoflavone,genisterin,sophoricol,5,7,4'-trihydroxyisoflavone,bonistein,5,7-dihydroxy-3-4-hydroxyphenyl-4h-chromen-4-one,genestein PubChem CID: 5280961 ChEBI: CHEBI:28088 IUPAC-Name: 5,7-Dihydroxy-3-(4-hydroxyphenyl)chromen-4-on SMILES: OC1=CC=C(C=C1)C1=COC2=CC(O)=CC(O)=C2C1=O

InChI-Schlüssel TZBJGXHYKVUXJN-UHFFFAOYSA-N
IUPAC-Name 5,7-Dihydroxy-3-(4-hydroxyphenyl)chromen-4-on
PubChem CID 5280961
CAS 446-72-0
ChEBI CHEBI:28088
MDL-Nummer MFCD00016952
Molekulargewicht (g/mol) 270.24
SMILES OC1=CC=C(C=C1)C1=COC2=CC(O)=CC(O)=C2C1=O
Synonym genistein,prunetol,genisteol,4',5,7-trihydroxyisoflavone,genisterin,sophoricol,5,7,4'-trihydroxyisoflavone,bonistein,5,7-dihydroxy-3-4-hydroxyphenyl-4h-chromen-4-one,genestein
Summenformel C15H10O5
12

Genistin, ≥ 99 %, Thermo Scientific Chemicals

CAS: 529-59-9 Summenformel: C21H20O10 Molekulargewicht (g/mol): 432.381 MDL-Nummer: MFCD00016883 InChI-Schlüssel: ZCOLJUOHXJRHDI-CMWLGVBASA-N Synonym: genistin,genistine,genisteol 7-monoglucoside,genistoside,genistein 7-glucoside,glucosyl-7-genistein,genistein 7-o-beta-d-glucoside,unii-1pog3scn5t,genistein glucoside,genistein-7-glucoside PubChem CID: 5281377 ChEBI: CHEBI:27514 IUPAC-Name: 5-Hydroxy-3-(4-hydroxyphenyl)-7-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-on SMILES: C1=CC(=CC=C1C2=COC3=CC(=CC(=C3C2=O)O)OC4C(C(C(C(O4)CO)O)O)O)O

InChI-Schlüssel ZCOLJUOHXJRHDI-CMWLGVBASA-N
IUPAC-Name 5-Hydroxy-3-(4-hydroxyphenyl)-7-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-on
PubChem CID 5281377
CAS 529-59-9
ChEBI CHEBI:27514
MDL-Nummer MFCD00016883
Molekulargewicht (g/mol) 432.381
SMILES C1=CC(=CC=C1C2=COC3=CC(=CC(=C3C2=O)O)OC4C(C(C(C(O4)CO)O)O)O)O
Synonym genistin,genistine,genisteol 7-monoglucoside,genistoside,genistein 7-glucoside,glucosyl-7-genistein,genistein 7-o-beta-d-glucoside,unii-1pog3scn5t,genistein glucoside,genistein-7-glucoside
Summenformel C21H20O10
13

7-Hydroxy-4'-Nitroisoflavon, 98 %, Thermo Scientific™

CAS: 15485-80-0 Summenformel: C15H9NO5 Molekulargewicht (g/mol): 283.24 MDL-Nummer: MFCD01546432 InChI-Schlüssel: CEESSYSSRMOMDE-UHFFFAOYSA-N Synonym: 7-hydroxy-4'-nitroisoflavone,7-hydroxy-3-4-nitrophenyl-4h-chromen-4-one,7-hydroxy-3-4-nitrophenyl chromen-4-one,7-hydroxy-3-4-nitrophenyl-4h-1-benzopyran-4-one,7-hydroxy-4-nitroisoflavone,7-hydroxy-4/'-nitroisoflavone,7-hydroxy-4'-nitro-isoflavone 3c PubChem CID: 7454026 IUPAC-Name: 7-Hydroxy-3-(4-nitrophenyl)chromen-4-on SMILES: OC1=CC=C2C(=O)C(=COC2=C1)C1=CC=C(C=C1)[N+]([O-])=O

InChI-Schlüssel CEESSYSSRMOMDE-UHFFFAOYSA-N
IUPAC-Name 7-Hydroxy-3-(4-nitrophenyl)chromen-4-on
PubChem CID 7454026
CAS 15485-80-0
MDL-Nummer MFCD01546432
Molekulargewicht (g/mol) 283.24
SMILES OC1=CC=C2C(=O)C(=COC2=C1)C1=CC=C(C=C1)[N+]([O-])=O
Synonym 7-hydroxy-4'-nitroisoflavone,7-hydroxy-3-4-nitrophenyl-4h-chromen-4-one,7-hydroxy-3-4-nitrophenyl chromen-4-one,7-hydroxy-3-4-nitrophenyl-4h-1-benzopyran-4-one,7-hydroxy-4-nitroisoflavone,7-hydroxy-4/'-nitroisoflavone,7-hydroxy-4'-nitro-isoflavone 3c
Summenformel C15H9NO5