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Phenylpropanoide und Polyketide

Phenylpropaniode sind organische Verbindungen, die durch einen aromatischen Ring und einen 3-Kohlenstoff-Propen-Schwanz charakterisiert sind. Polyketide sind Verbindungen, die dadurch charakterisiert sind, dass zwei oder mehr funktionelle Carbonylgruppen mit einem einzigen Kohlenstoffatom verbunden sind.
Phenylpropansäuren (437)
Zimtsäuren und Derivate (412)
Flavonoide (358)
Cumarine und Derivate (269)
Lineare 1,3-Diarylpropanoide (107)
Depside und Depsidone (96)
Tetracycline (89)
Isoflavone (81)
Zimtaldehyde (67)
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Makrolid-Lactame (41)
Diarylheptanoide (38)
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Anthracycline (33)
Zimtalkohole (20)
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Isocumarine und Derivate (13)
Makrolide und Analoga (10)
Dihydrocumarine (8)
Ochratoxine und verwandte Substanzen (7)
Angucycline (2)

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1 – 15 von 950 Ergebnisse
1

trans-4-Hydroxyzimtsäure, 98%, Thermo Scientific Chemicals

CAS: 501-98-4 Summenformel: C9H8O3 Molekulargewicht (g/mol): 164.16 MDL-Nummer: MFCD00004399 InChI-Schlüssel: NGSWKAQJJWESNS-ZZXKWVIFSA-N Synonym: p-coumaric acid,4-hydroxycinnamic acid,p-hydroxycinnamic acid,4-coumaric acid,trans-4-hydroxycinnamic acid,trans-p-coumaric acid,p-cumaric acid,3-4-hydroxyphenyl acrylic acid,para-coumaric acid,hydroxycinnamic acid PubChem CID: 637542 ChEBI: CHEBI:32374 IUPAC-Name: (E)-3-(4-Hydroxyphenyl)prop-2-ionsäure SMILES: C1=CC(=CC=C1C=CC(=O)O)O

EDGE
InChI-Schlüssel NGSWKAQJJWESNS-ZZXKWVIFSA-N
IUPAC-Name (E)-3-(4-Hydroxyphenyl)prop-2-ionsäure
PubChem CID 637542
CAS 501-98-4
ChEBI CHEBI:32374
MDL-Nummer MFCD00004399
Molekulargewicht (g/mol) 164.16
SMILES C1=CC(=CC=C1C=CC(=O)O)O
Synonym p-coumaric acid,4-hydroxycinnamic acid,p-hydroxycinnamic acid,4-coumaric acid,trans-4-hydroxycinnamic acid,trans-p-coumaric acid,p-cumaric acid,3-4-hydroxyphenyl acrylic acid,para-coumaric acid,hydroxycinnamic acid
Summenformel C9H8O3
2

Paraffin flüssig, technisch, d = 0,88, für Ölbäder, Fisher Chemical™

CAS: 8042-47-5 Summenformel: MFCD00131611 Molekulargewicht (g/mol): 0.00 MDL-Nummer: MFCD00131611 InChI-Schlüssel: FFNDMZIBVDSQFI-UHFFFAOYSA-N Synonym: delphinidin chloride,delphinidin,delphinidine,delphinidol,ephdine,delfinidol chloride,unii-em6md4aehe,ccris 2518,em6md4aehe,3,5,7-trihydroxy-2-3,4,5-trihydroxyphenyl benzopyrylium chloride PubChem CID: 68245 ChEBI: CHEBI:38701 IUPAC-Name: 2-(3,4,5-Trihydroxyphenyl)chromenylium-3,5,7-triol; Chlorid SMILES: *

EDGE
InChI-Schlüssel FFNDMZIBVDSQFI-UHFFFAOYSA-N
IUPAC-Name 2-(3,4,5-Trihydroxyphenyl)chromenylium-3,5,7-triol; Chlorid
PubChem CID 68245
CAS 8042-47-5
ChEBI CHEBI:38701
MDL-Nummer MFCD00131611
Molekulargewicht (g/mol) 0.00
SMILES *
Synonym delphinidin chloride,delphinidin,delphinidine,delphinidol,ephdine,delfinidol chloride,unii-em6md4aehe,ccris 2518,em6md4aehe,3,5,7-trihydroxy-2-3,4,5-trihydroxyphenyl benzopyrylium chloride
Summenformel MFCD00131611
3

Trans-Cinnamaldehyd, 99 %, Thermo Scientific Chemicals

CAS: 14371-10-9 Summenformel: C9H8O Molekulargewicht (g/mol): 132.16 MDL-Nummer: MFCD00007000 InChI-Schlüssel: KJPRLNWUNMBNBZ-QPJJXVBHSA-N Synonym: cinnamaldehyde,trans-cinnamaldehyde,cinnamic aldehyde,e-cinnamaldehyde,cinnamal,3-phenylacrylaldehyde,zimtaldehyde,cinnamylaldehyde,3-phenylpropenal,2e-3-phenylprop-2-enal PubChem CID: 637511 ChEBI: CHEBI:16731 SMILES: O=C\C=C\C1=CC=CC=C1

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InChI-Schlüssel KJPRLNWUNMBNBZ-QPJJXVBHSA-N
PubChem CID 637511
CAS 14371-10-9
ChEBI CHEBI:16731
MDL-Nummer MFCD00007000
Molekulargewicht (g/mol) 132.16
SMILES O=C\C=C\C1=CC=CC=C1
Synonym cinnamaldehyde,trans-cinnamaldehyde,cinnamic aldehyde,e-cinnamaldehyde,cinnamal,3-phenylacrylaldehyde,zimtaldehyde,cinnamylaldehyde,3-phenylpropenal,2e-3-phenylprop-2-enal
Summenformel C9H8O
4

4-Isobutyl-alpha-Methylphenylessigsäure, 99 %, Thermo Scientific Chemicals

CAS: 15687-27-1 Summenformel: C13H18O2 Molekulargewicht (g/mol): 206.29 MDL-Nummer: MFCD00010393 InChI-Schlüssel: HEFNNWSXXWATRW-UHFFFAOYNA-N Synonym: ibuprofen,2-4-isobutylphenyl propanoic acid,motrin,brufen,nurofen,advil,dolgit,liptan,nuprin,anflagen PubChem CID: 3672 ChEBI: CHEBI:5855 IUPAC-Name: 2-[4-(2-Methylpropyl)phenyl]propansäure SMILES: CC(C)CC1=CC=C(C=C1)C(C)C(O)=O

EDGE
InChI-Schlüssel HEFNNWSXXWATRW-UHFFFAOYNA-N
IUPAC-Name 2-[4-(2-Methylpropyl)phenyl]propansäure
PubChem CID 3672
CAS 15687-27-1
ChEBI CHEBI:5855
MDL-Nummer MFCD00010393
Molekulargewicht (g/mol) 206.29
SMILES CC(C)CC1=CC=C(C=C1)C(C)C(O)=O
Synonym ibuprofen,2-4-isobutylphenyl propanoic acid,motrin,brufen,nurofen,advil,dolgit,liptan,nuprin,anflagen
Summenformel C13H18O2
5

4-Methylumbelliferon, 97 %, Thermo Scientific Chemicals

CAS: 90-33-5 Summenformel: C10H8O3 Molekulargewicht (g/mol): 176.17 MDL-Nummer: MFCD00006866 InChI-Schlüssel: HSHNITRMYYLLCV-UHFFFAOYSA-N Synonym: 4-methylumbelliferone,hymecromone,7-hydroxy-4-methylcoumarin,imecromone,7-hydroxy-4-methyl-2h-chromen-2-one,cholestil,mendiaxon,4-methyl-7-hydroxycoumarin,beta-methylumbelliferone,bilcolic PubChem CID: 5280567 ChEBI: CHEBI:17224 IUPAC-Name: 7-Hydroxy-4-Methylchromen-2-on SMILES: CC1=CC(=O)OC2=CC(O)=CC=C12

EDGE
InChI-Schlüssel HSHNITRMYYLLCV-UHFFFAOYSA-N
IUPAC-Name 7-Hydroxy-4-Methylchromen-2-on
PubChem CID 5280567
CAS 90-33-5
ChEBI CHEBI:17224
MDL-Nummer MFCD00006866
Molekulargewicht (g/mol) 176.17
SMILES CC1=CC(=O)OC2=CC(O)=CC=C12
Synonym 4-methylumbelliferone,hymecromone,7-hydroxy-4-methylcoumarin,imecromone,7-hydroxy-4-methyl-2h-chromen-2-one,cholestil,mendiaxon,4-methyl-7-hydroxycoumarin,beta-methylumbelliferone,bilcolic
Summenformel C10H8O3
6

Trans-Zimtaldehyd, ≥98 %, Thermo Scientific Chemicals

CAS: 14371-10-9 Summenformel: C9H8O Molekulargewicht (g/mol): 132.16 MDL-Nummer: MFCD00007000 InChI-Schlüssel: KJPRLNWUNMBNBZ-QPJJXVBHSA-N Synonym: cinnamaldehyde,trans-cinnamaldehyde,cinnamic aldehyde,e-cinnamaldehyde,cinnamal,3-phenylacrylaldehyde,zimtaldehyde,cinnamylaldehyde,3-phenylpropenal,2e-3-phenylprop-2-enal PubChem CID: 637511 ChEBI: CHEBI:16731 SMILES: O=C\C=C\C1=CC=CC=C1

EDGE
InChI-Schlüssel KJPRLNWUNMBNBZ-QPJJXVBHSA-N
PubChem CID 637511
CAS 14371-10-9
ChEBI CHEBI:16731
MDL-Nummer MFCD00007000
Molekulargewicht (g/mol) 132.16
SMILES O=C\C=C\C1=CC=CC=C1
Synonym cinnamaldehyde,trans-cinnamaldehyde,cinnamic aldehyde,e-cinnamaldehyde,cinnamal,3-phenylacrylaldehyde,zimtaldehyde,cinnamylaldehyde,3-phenylpropenal,2e-3-phenylprop-2-enal
Summenformel C9H8O
7

Thermo Scientific Chemicals Curcumin ≥ 98 %

CAS: 458-37-7 Summenformel: C21H20O6 Molekulargewicht (g/mol): 368.39 MDL-Nummer: MFCD00008365 InChI-Schlüssel: ZIUSSTSXXLLKKK-KOBPDPAPSA-N Synonym: curcumin,diferuloylmethane,natural yellow 3,turmeric yellow,turmeric,curcuma,kacha haldi,gelbwurz,halad,curcumin i PubChem CID: 969516 ChEBI: CHEBI:3962 SMILES: COC1=CC(\C=C\C(\O)=C\C(=O)\C=C\C2=CC=C(O)C(OC)=C2)=CC=C1O

EDGE
InChI-Schlüssel ZIUSSTSXXLLKKK-KOBPDPAPSA-N
PubChem CID 969516
CAS 458-37-7
ChEBI CHEBI:3962
MDL-Nummer MFCD00008365
Molekulargewicht (g/mol) 368.39
SMILES COC1=CC(\C=C\C(\O)=C\C(=O)\C=C\C2=CC=C(O)C(OC)=C2)=CC=C1O
Synonym curcumin,diferuloylmethane,natural yellow 3,turmeric yellow,turmeric,curcuma,kacha haldi,gelbwurz,halad,curcumin i
Summenformel C21H20O6
8

Phenylbenzoat, 99%

CAS: 93-99-2 Summenformel: C13H10O2 Molekulargewicht (g/mol): 198.22 MDL-Nummer: MFCD00003072 InChI-Schlüssel: FCJSHPDYVMKCHI-UHFFFAOYSA-N Synonym: benzoic acid phenyl ester,diphenylcarboxylate,benzoic acid, phenyl ester,benzoic acid phenyl,phenylbenzoate,unii-b8a3wvz590,phenol, benzoate,dsstox_cid_28185,dsstox_rid_82744,dsstox_gsid_48210 PubChem CID: 7169 ChEBI: CHEBI:86919 IUPAC-Name: Phenylbenzoat SMILES: C1=CC=C(C=C1)C(=O)OC2=CC=CC=C2

EDGE
InChI-Schlüssel FCJSHPDYVMKCHI-UHFFFAOYSA-N
IUPAC-Name Phenylbenzoat
PubChem CID 7169
CAS 93-99-2
ChEBI CHEBI:86919
MDL-Nummer MFCD00003072
Molekulargewicht (g/mol) 198.22
SMILES C1=CC=C(C=C1)C(=O)OC2=CC=CC=C2
Synonym benzoic acid phenyl ester,diphenylcarboxylate,benzoic acid, phenyl ester,benzoic acid phenyl,phenylbenzoate,unii-b8a3wvz590,phenol, benzoate,dsstox_cid_28185,dsstox_rid_82744,dsstox_gsid_48210
Summenformel C13H10O2
9

7-Diethylamino-4-Methylcumarin, 99 %, Thermo Scientific Chemicals

CAS: 91-44-1 Summenformel: C14H17NO2 Molekulargewicht (g/mol): 231.295 MDL-Nummer: MFCD00006864 InChI-Schlüssel: AFYCEAFSNDLKSX-UHFFFAOYSA-N Synonym: 7-diethylamino-4-methylcoumarin,coumarin 1,7-diethylamino-4-methyl-2h-chromen-2-one,coumarin 47,coumarin 460,4-methyl-7-diethylamino coumarin,blancophor aw,blancophor ffg,4-methyl-7-diethylaminocoumarin,hakkol p PubChem CID: 7050 ChEBI: CHEBI:51938 IUPAC-Name: 7-(Diethylamino)-4-Methylchromen-2-on SMILES: CCN(CC)C1=CC2=C(C=C1)C(=CC(=O)O2)C

EDGE
InChI-Schlüssel AFYCEAFSNDLKSX-UHFFFAOYSA-N
IUPAC-Name 7-(Diethylamino)-4-Methylchromen-2-on
PubChem CID 7050
CAS 91-44-1
ChEBI CHEBI:51938
MDL-Nummer MFCD00006864
Molekulargewicht (g/mol) 231.295
SMILES CCN(CC)C1=CC2=C(C=C1)C(=CC(=O)O2)C
Synonym 7-diethylamino-4-methylcoumarin,coumarin 1,7-diethylamino-4-methyl-2h-chromen-2-one,coumarin 47,coumarin 460,4-methyl-7-diethylamino coumarin,blancophor aw,blancophor ffg,4-methyl-7-diethylaminocoumarin,hakkol p
Summenformel C14H17NO2
10

Ibuprofen, 99%, Thermo Scientific Chemicals

CAS: 15687-27-1 Summenformel: C13H18O2 Molekulargewicht (g/mol): 206.29 MDL-Nummer: MFCD00010393 InChI-Schlüssel: HEFNNWSXXWATRW-UHFFFAOYNA-N PubChem CID: 3672 ChEBI: CHEBI:5855 IUPAC-Name: 2-[4-(2-Methylpropyl)phenyl]propansäure SMILES: CC(C)CC1=CC=C(C=C1)C(C)C(O)=O

EDGE
InChI-Schlüssel HEFNNWSXXWATRW-UHFFFAOYNA-N
IUPAC-Name 2-[4-(2-Methylpropyl)phenyl]propansäure
PubChem CID 3672
CAS 15687-27-1
ChEBI CHEBI:5855
MDL-Nummer MFCD00010393
Molekulargewicht (g/mol) 206.29
SMILES CC(C)CC1=CC=C(C=C1)C(C)C(O)=O
Summenformel C13H18O2
11

3-(3,4-Dihydroxyphenyl)propionsäure, ≥ 98 %, Thermo Scientific Chemicals

CAS: 1078-61-1 Summenformel: C9H10O4 Molekulargewicht (g/mol): 182.175 MDL-Nummer: MFCD00002776 InChI-Schlüssel: DZAUWHJDUNRCTF-UHFFFAOYSA-N Synonym: dihydrocaffeic acid,3-3,4-dihydroxyphenyl propionic acid,hydrocaffeic acid,3,4-dihydroxyhydrocinnamic acid,3-3,4-dihydroxyphenyl propanoic acid,benzenepropanoic acid, 3,4-dihydroxy,hydrocaffeic acid polymer,hykop,3,4-dihydroxyhydrocinnamate,3,4-dihydroxybenzenepropionic acid PubChem CID: 348154 ChEBI: CHEBI:48400 IUPAC-Name: 3-(3,4-Dihydroxyphenyl)propansäure SMILES: C1=CC(=C(C=C1CCC(=O)O)O)O

EDGE
InChI-Schlüssel DZAUWHJDUNRCTF-UHFFFAOYSA-N
IUPAC-Name 3-(3,4-Dihydroxyphenyl)propansäure
PubChem CID 348154
CAS 1078-61-1
ChEBI CHEBI:48400
MDL-Nummer MFCD00002776
Molekulargewicht (g/mol) 182.175
SMILES C1=CC(=C(C=C1CCC(=O)O)O)O
Synonym dihydrocaffeic acid,3-3,4-dihydroxyphenyl propionic acid,hydrocaffeic acid,3,4-dihydroxyhydrocinnamic acid,3-3,4-dihydroxyphenyl propanoic acid,benzenepropanoic acid, 3,4-dihydroxy,hydrocaffeic acid polymer,hykop,3,4-dihydroxyhydrocinnamate,3,4-dihydroxybenzenepropionic acid
Summenformel C9H10O4
12

Paraffin, flüssig, rein, Thermo Scientific Chemicals

CAS: 8012-95-1 Summenformel: MFCD00131611 Molekulargewicht (g/mol): 0.00 MDL-Nummer: MFCD00131611 InChI-Schlüssel: FFNDMZIBVDSQFI-UHFFFAOYSA-N Synonym: delphinidin chloride,delphinidin,delphinidine,delphinidol,ephdine,delfinidol chloride,unii-em6md4aehe,ccris 2518,em6md4aehe,3,5,7-trihydroxy-2-3,4,5-trihydroxyphenyl benzopyrylium chloride PubChem CID: 68245 ChEBI: CHEBI:38701 IUPAC-Name: 2-(3,4,5-Trihydroxyphenyl)chromenylium-3,5,7-triol; Chlorid SMILES: *

InChI-Schlüssel FFNDMZIBVDSQFI-UHFFFAOYSA-N
IUPAC-Name 2-(3,4,5-Trihydroxyphenyl)chromenylium-3,5,7-triol; Chlorid
PubChem CID 68245
CAS 8012-95-1
ChEBI CHEBI:38701
MDL-Nummer MFCD00131611
Molekulargewicht (g/mol) 0.00
SMILES *
Synonym delphinidin chloride,delphinidin,delphinidine,delphinidol,ephdine,delfinidol chloride,unii-em6md4aehe,ccris 2518,em6md4aehe,3,5,7-trihydroxy-2-3,4,5-trihydroxyphenyl benzopyrylium chloride
Summenformel MFCD00131611
13

Thermo Scientific Chemicals 4-Dimethylaminocinnamaldehyd, 98 %

CAS: 6203-18-5 Summenformel: C11H13NO Molekulargewicht (g/mol): 175.23 MDL-Nummer: MFCD00007002 InChI-Schlüssel: RUKJCCIJLIMGEP-ONEGZZNKSA-N Synonym: 4-dimethylamino cinnamaldehyde,4-dimethylaminocinnamaldehyde,p-dimethylaminocinnamaldehyde,3-4-dimethylamino phenyl acrylaldehyde,4-dimethylcinnamaldehyde,p-dimethylaminocinnamic aldehyde,p-dimethylamino cinnamaldehyde,cinnamaldehyde, p-dimethylamino,unii-9rsi7wz9f0,dmaca reagent PubChem CID: 5284506 IUPAC-Name: (E)-3-[4-(Dimethylamino)phenyl]prop-2-enal SMILES: CN(C)C1=CC=C(C=C1)C=CC=O

InChI-Schlüssel RUKJCCIJLIMGEP-ONEGZZNKSA-N
IUPAC-Name (E)-3-[4-(Dimethylamino)phenyl]prop-2-enal
PubChem CID 5284506
CAS 6203-18-5
MDL-Nummer MFCD00007002
Molekulargewicht (g/mol) 175.23
SMILES CN(C)C1=CC=C(C=C1)C=CC=O
Synonym 4-dimethylamino cinnamaldehyde,4-dimethylaminocinnamaldehyde,p-dimethylaminocinnamaldehyde,3-4-dimethylamino phenyl acrylaldehyde,4-dimethylcinnamaldehyde,p-dimethylaminocinnamic aldehyde,p-dimethylamino cinnamaldehyde,cinnamaldehyde, p-dimethylamino,unii-9rsi7wz9f0,dmaca reagent
Summenformel C11H13NO
14

Hesperidin, 95%

CAS: 520-26-3 Summenformel: C28H34O15 Molekulargewicht (g/mol): 610.57 MDL-Nummer: MFCD00075663 InChI-Schlüssel: QUQPHWDTPGMPEX-QJBIFVCTSA-N Synonym: Hesperetin 7-rhamnoglucoside; Hesperitin-7-rutinoside PubChem CID: 45358131 IUPAC-Name: (2S)-5-Hydroxy-2-(3-hydroxy-4-methoxyphenyl)-7-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-({[(2R,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy}methyl)oxan-2-yl]oxy}-3,4-dihydro-2H-1-benzopyran-4-on SMILES: COC1=CC=C(C=C1O)[C@@H]1CC(=O)C2=C(O)C=C(O[C@@H]3O[C@H](CO[C@@H]4O[C@@H](C)[C@H](O)[C@@H](O)[C@H]4O)[C@@H](O)[C@H](O)[C@H]3O)C=C2O1

InChI-Schlüssel QUQPHWDTPGMPEX-QJBIFVCTSA-N
IUPAC-Name (2S)-5-Hydroxy-2-(3-hydroxy-4-methoxyphenyl)-7-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-({[(2R,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy}methyl)oxan-2-yl]oxy}-3,4-dihydro-2H-1-benzopyran-4-on
PubChem CID 45358131
CAS 520-26-3
MDL-Nummer MFCD00075663
Molekulargewicht (g/mol) 610.57
SMILES COC1=CC=C(C=C1O)[C@@H]1CC(=O)C2=C(O)C=C(O[C@@H]3O[C@H](CO[C@@H]4O[C@@H](C)[C@H](O)[C@@H](O)[C@H]4O)[C@@H](O)[C@H](O)[C@H]3O)C=C2O1
Synonym Hesperetin 7-rhamnoglucoside; Hesperitin-7-rutinoside
Summenformel C28H34O15
15

3',5,7-Trihydroxy-4'-Methoxyflavanon, 97 %, Thermo Scientific Chemicals

CAS: 520-33-2 Summenformel: C16H14O6 Molekulargewicht (g/mol): 302.28 MDL-Nummer: MFCD00075646 InChI-Schlüssel: AIONOLUJZLIMTK-AWEZNQCLSA-N Synonym: hesperetin,hesperitin,3',5,7-trihydroxy-4'-methoxyflavanone,hesperin,yso2,cyanidanon 4'-methyl ether 1626,5,7,3'-trihydroxy-4'-methoxyflavanone,--hesperetin,prestwick_908,unii-q9q3d557f1 PubChem CID: 72281 ChEBI: CHEBI:28230 IUPAC-Name: (2S)-5,7-Dihydroxy-2-(3-hydroxy-4-methoxyphenyl)-2,3-dihydrochromen-4-on SMILES: COC1=CC=C(C=C1O)[C@@H]1CC(=O)C2=C(O)C=C(O)C=C2O1

InChI-Schlüssel AIONOLUJZLIMTK-AWEZNQCLSA-N
IUPAC-Name (2S)-5,7-Dihydroxy-2-(3-hydroxy-4-methoxyphenyl)-2,3-dihydrochromen-4-on
PubChem CID 72281
CAS 520-33-2
ChEBI CHEBI:28230
MDL-Nummer MFCD00075646
Molekulargewicht (g/mol) 302.28
SMILES COC1=CC=C(C=C1O)[C@@H]1CC(=O)C2=C(O)C=C(O)C=C2O1
Synonym hesperetin,hesperitin,3',5,7-trihydroxy-4'-methoxyflavanone,hesperin,yso2,cyanidanon 4'-methyl ether 1626,5,7,3'-trihydroxy-4'-methoxyflavanone,--hesperetin,prestwick_908,unii-q9q3d557f1
Summenformel C16H14O6