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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 (354)
Cumarine und Derivate (268)
Lineare 1,3-Diarylpropanoide (106)
Depside und Depsidone (94)
Tetracycline (85)
Isoflavone (77)
Zimtaldehyde (67)
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Makrolid-Lactame (39)
Diarylheptanoide (38)
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Anthracycline (30)
Zimtalkohole (20)
Gerbstoffe (19)
Isocumarine und Derivate (13)
Makrolide und Analoga (10)
Dihydrocumarine (8)
Ochratoxine und verwandte Substanzen (7)
Angucycline (2)

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1 – 15 von 938 Ergebnisse
1

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

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
2

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
3

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
4

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
5

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
6

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
7

Curcumin, 95 % (Gesamtgehalt an Curcuminoiden), aus Kurkumarhizom, Thermo Scientific Chemicals

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 IUPAC-Name: (1E,6E)-1,7-Bis(4-hydroxy-3-methoxyphenyl)hepta-1,6-dien-3,5-dion 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
IUPAC-Name (1E,6E)-1,7-Bis(4-hydroxy-3-methoxyphenyl)hepta-1,6-dien-3,5-dion
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

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
9

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: *

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
10

Rutin Hydrat, 97+ %, Thermo Scientific Chemicals

CAS: 207671-50-9 Summenformel: C27H30O16 Molekulargewicht (g/mol): 610.52 MDL-Nummer: MFCD01319140 InChI-Schlüssel: IKGXIBQEEMLURG-NVPNHPEKSA-N Synonym: rutin,rutoside,phytomelin,quercetin 3-rutinoside,birutan,eldrin,myrticolorin,venoruton,3-rutinosyl quercetin,bioflavonoid PubChem CID: 5280805 ChEBI: CHEBI:28527 IUPAC-Name: 2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3-{[(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}-4H-chromen-4-one SMILES: C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=C(OC4=CC(O)=CC(O)=C4C3=O)C3=CC(O)=C(O)C=C3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O

InChI-Schlüssel IKGXIBQEEMLURG-NVPNHPEKSA-N
IUPAC-Name 2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3-{[(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}-4H-chromen-4-one
PubChem CID 5280805
CAS 207671-50-9
ChEBI CHEBI:28527
MDL-Nummer MFCD01319140
Molekulargewicht (g/mol) 610.52
SMILES C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=C(OC4=CC(O)=CC(O)=C4C3=O)C3=CC(O)=C(O)C=C3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O
Synonym rutin,rutoside,phytomelin,quercetin 3-rutinoside,birutan,eldrin,myrticolorin,venoruton,3-rutinosyl quercetin,bioflavonoid
Summenformel C27H30O16
11

Kaempferol, 98+ %, Thermo Scientific Chemicals

CAS: 520-18-3 Summenformel: C15H10O6 Molekulargewicht (g/mol): 286.24 MDL-Nummer: MFCD00016938 InChI-Schlüssel: IYRMWMYZSQPJKC-UHFFFAOYSA-N Synonym: kaempferol,kaempherol,kempferol,populnetin,rhamnolutein,robigenin,trifolitin,pelargidenolon,rhamnolutin,swartziol PubChem CID: 5280863 ChEBI: CHEBI:28499 SMILES: OC1=CC=C(C=C1)C1=C(O)C(=O)C2=C(O)C=C(O)C=C2O1

InChI-Schlüssel IYRMWMYZSQPJKC-UHFFFAOYSA-N
PubChem CID 5280863
CAS 520-18-3
ChEBI CHEBI:28499
MDL-Nummer MFCD00016938
Molekulargewicht (g/mol) 286.24
SMILES OC1=CC=C(C=C1)C1=C(O)C(=O)C2=C(O)C=C(O)C=C2O1
Synonym kaempferol,kaempherol,kempferol,populnetin,rhamnolutein,robigenin,trifolitin,pelargidenolon,rhamnolutin,swartziol
Summenformel C15H10O6
12

Zimtalkohol, 98 %, Thermo Scientific Chemicals

CAS: 104-54-1 Summenformel: C9H10O Molekulargewicht (g/mol): 134.178 MDL-Nummer: MFCD00002921 InChI-Schlüssel: OOCCDEMITAIZTP-QPJJXVBHSA-N Synonym: cinnamyl alcohol,cinnamic alcohol,3-phenyl-2-propen-1-ol,3-phenylprop-2-en-1-ol,zimtalcohol,styryl carbinol,e-3-phenylprop-2-en-1-ol,3-phenylallyl alcohol,trans-cinnamyl alcohol,styryl alcohol PubChem CID: 5315892 ChEBI: CHEBI:33227 IUPAC-Name: (E)-3-Phenylprop-2-en-1-ol SMILES: C1=CC=C(C=C1)C=CCO

InChI-Schlüssel OOCCDEMITAIZTP-QPJJXVBHSA-N
IUPAC-Name (E)-3-Phenylprop-2-en-1-ol
PubChem CID 5315892
CAS 104-54-1
ChEBI CHEBI:33227
MDL-Nummer MFCD00002921
Molekulargewicht (g/mol) 134.178
SMILES C1=CC=C(C=C1)C=CCO
Synonym cinnamyl alcohol,cinnamic alcohol,3-phenyl-2-propen-1-ol,3-phenylprop-2-en-1-ol,zimtalcohol,styryl carbinol,e-3-phenylprop-2-en-1-ol,3-phenylallyl alcohol,trans-cinnamyl alcohol,styryl alcohol
Summenformel C9H10O
13

Thermo Scientific Chemicals Tebuconazol

CAS: 107534-96-3 Summenformel: C16H22ClN3O Molekulargewicht (g/mol): 307.82 MDL-Nummer: MFCD02674797 InChI-Schlüssel: PXMNMQRDXWABCY-UHFFFAOYNA-N IUPAC-Name: 1-(4-Chlorphenyl)-4,4-Dimethyl-3-[(1H-1,2,4-Triazol-1-yl)methyl]pentan-3-ol SMILES: CC(C)(C)C(O)(CCC1=CC=C(Cl)C=C1)CN1C=NC=N1

InChI-Schlüssel PXMNMQRDXWABCY-UHFFFAOYNA-N
IUPAC-Name 1-(4-Chlorphenyl)-4,4-Dimethyl-3-[(1H-1,2,4-Triazol-1-yl)methyl]pentan-3-ol
CAS 107534-96-3
MDL-Nummer MFCD02674797
Molekulargewicht (g/mol) 307.82
SMILES CC(C)(C)C(O)(CCC1=CC=C(Cl)C=C1)CN1C=NC=N1
Summenformel C16H22ClN3O
14

Chrysin, ≥ 99 %, Thermo Scientific Chemicals

CAS: 480-40-0 Summenformel: C15H10O4 Molekulargewicht (g/mol): 254.24 MDL-Nummer: MFCD00006834 InChI-Schlüssel: RTIXKCRFFJGDFG-UHFFFAOYSA-N Synonym: chrysin,5,7-dihydroxyflavone,chrysine,5,7-dihydroxy-2-phenyl-4h-chromen-4-one,crysin,4h-1-benzopyran-4-one, 5,7-dihydroxy-2-phenyl,unii-3cn01f5zj5,flavone, 5,7-dihydroxy,5,7-dihydroxy-2-phenyl-4h-1-benzopyran-4-one,chembl117 PubChem CID: 5281607 ChEBI: CHEBI:75095 IUPAC-Name: 5,7-Dihydroxy-2-phenylchromen-4-on SMILES: C1=CC=C(C=C1)C2=CC(=O)C3=C(C=C(C=C3O2)O)O

InChI-Schlüssel RTIXKCRFFJGDFG-UHFFFAOYSA-N
IUPAC-Name 5,7-Dihydroxy-2-phenylchromen-4-on
PubChem CID 5281607
CAS 480-40-0
ChEBI CHEBI:75095
MDL-Nummer MFCD00006834
Molekulargewicht (g/mol) 254.24
SMILES C1=CC=C(C=C1)C2=CC(=O)C3=C(C=C(C=C3O2)O)O
Synonym chrysin,5,7-dihydroxyflavone,chrysine,5,7-dihydroxy-2-phenyl-4h-chromen-4-one,crysin,4h-1-benzopyran-4-one, 5,7-dihydroxy-2-phenyl,unii-3cn01f5zj5,flavone, 5,7-dihydroxy,5,7-dihydroxy-2-phenyl-4h-1-benzopyran-4-one,chembl117
Summenformel C15H10O4
15

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

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