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Phenylpropanoids and polyketides

Phenylpropaniods are organic compounds characterized by having an aromatic ring and a three-carbon propene tail. Polyketides are compounds characterized by having two or more carbonyl functional groups connected with a single carbon atom.
Cinnamic acids and derivatives (929)
Flavonoids (924)
Linear 1 3-diarylpropanoids (800)
Coumarins and derivatives (713)
Depsides and depsidones (520)
Phenylpropanoic acids (346)
Isoflavonoids (220)
Cinnamaldehydes (131)
Stilbenes (110)
Macrolide lactams (93)
Anthracyclines (89)
Macrolides and analogues (74)
Tetracyclines (62)
Cinnamyl alcohols (60)
Isocoumarins and derivatives (30)
Macrolactams (24)
Dihydrocoumarins (16)
Neoflavonoids (14)
Ochratoxins and related substances (11)
Angucyclines (1)

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661 – 675 of 4,435 results
661

omega-Laurinlactam 99.0+%, TCI America™

CAS: 947-04-6 Molecular Formula: C12H23NO Molecular Weight (g/mol): 197.32 MDL Number: MFCD00005104 InChI Key: JHWNWJKBPDFINM-UHFFFAOYSA-N Synonym: Cyclododecanone Isooxime PubChem CID: 13690 IUPAC Name: 1-azacyclotridecan-2-one SMILES: O=C1CCCCCCCCCCCN1

PubChem CID 13690
CAS 947-04-6
Molecular Weight (g/mol) 197.32
MDL Number MFCD00005104
SMILES O=C1CCCCCCCCCCCN1
Synonym Cyclododecanone Isooxime
IUPAC Name 1-azacyclotridecan-2-one
InChI Key JHWNWJKBPDFINM-UHFFFAOYSA-N
Molecular Formula C12H23NO
662

Coumarin 343, TCI America™

CAS: 55804-65-4 Molecular Formula: C16H15NO4 Molecular Weight (g/mol): 285.299 MDL Number: MFCD00051335 InChI Key: KCDCNGXPPGQERR-UHFFFAOYSA-N Synonym: coumarin 343,11-oxo-2,3,5,6,7,11-hexahydro-1h-pyrano 2,3-f pyrido 3,2,1-ij quinoline-10-carboxylic acid,1h,5h,11h-1 benzopyrano 6,7,8-ij quinolizine-10-carboxylicacid, 2,3,6,7-tetrahydro-11-oxo,2,3,6,7-tetrahydro-11-oxo-1h,5h,11h-1 benzopyrano 6,7,8-ij quinolizine-10-carboxylic acid,1h,5h,11h-1 benzopyrano 6,7,8-ij quinolizine-10-carboxylic acid, 2,3,6,7-tetrahydro-11-oxo,coumarin343,11-oxo-2,3,6,7-tetrahydro-1h,5h,11h-pyrano 2,3-f pyrido 3,2,1-ij quinoline-10-carboxylic acid,coumarin-343 PubChem CID: 108770 ChEBI: CHEBI:51941 SMILES: C1CC2=C3C(=C4C(=C2)C=C(C(=O)O4)C(=O)O)CCCN3C1

PubChem CID 108770
CAS 55804-65-4
Molecular Weight (g/mol) 285.299
ChEBI CHEBI:51941
MDL Number MFCD00051335
SMILES C1CC2=C3C(=C4C(=C2)C=C(C(=O)O4)C(=O)O)CCCN3C1
Synonym coumarin 343,11-oxo-2,3,5,6,7,11-hexahydro-1h-pyrano 2,3-f pyrido 3,2,1-ij quinoline-10-carboxylic acid,1h,5h,11h-1 benzopyrano 6,7,8-ij quinolizine-10-carboxylicacid, 2,3,6,7-tetrahydro-11-oxo,2,3,6,7-tetrahydro-11-oxo-1h,5h,11h-1 benzopyrano 6,7,8-ij quinolizine-10-carboxylic acid,1h,5h,11h-1 benzopyrano 6,7,8-ij quinolizine-10-carboxylic acid, 2,3,6,7-tetrahydro-11-oxo,coumarin343,11-oxo-2,3,6,7-tetrahydro-1h,5h,11h-pyrano 2,3-f pyrido 3,2,1-ij quinoline-10-carboxylic acid,coumarin-343
InChI Key KCDCNGXPPGQERR-UHFFFAOYSA-N
Molecular Formula C16H15NO4
664

7-Acetoxy-4-methylcoumarin 98.0+%, TCI America™

CAS: 5-9-2747 Molecular Formula: C12H10O4 Molecular Weight (g/mol): 218.21 MDL Number: MFCD00006865 InChI Key: HXVZGASCDAGAPS-UHFFFAOYSA-N Synonym: 7-acetoxy-4-methylcoumarin,4-methylumbelliferyl acetate,4-methyl-2-oxo-2h-chromen-7-yl acetate,mu-ac,2h-1-benzopyran-2-one, 7-acetyloxy-4-methyl,7-acetyl-4-methylcoumarin,beta-methylumbelliferyl acetate,7-acetyloxy-4-methyl-2-benzopyrone,4-methyl-2-oxochromen-7-yl acetate,4-methyl-7-acetyloxy coumarin PubChem CID: 366 ChEBI: CHEBI:17763 IUPAC Name: (4-methyl-2-oxochromen-7-yl) acetate SMILES: CC1=CC(=O)OC2=C1C=CC(=C2)OC(=O)C

PubChem CID 366
CAS 5-9-2747
Molecular Weight (g/mol) 218.21
ChEBI CHEBI:17763
MDL Number MFCD00006865
SMILES CC1=CC(=O)OC2=C1C=CC(=C2)OC(=O)C
Synonym 7-acetoxy-4-methylcoumarin,4-methylumbelliferyl acetate,4-methyl-2-oxo-2h-chromen-7-yl acetate,mu-ac,2h-1-benzopyran-2-one, 7-acetyloxy-4-methyl,7-acetyl-4-methylcoumarin,beta-methylumbelliferyl acetate,7-acetyloxy-4-methyl-2-benzopyrone,4-methyl-2-oxochromen-7-yl acetate,4-methyl-7-acetyloxy coumarin
IUPAC Name (4-methyl-2-oxochromen-7-yl) acetate
InChI Key HXVZGASCDAGAPS-UHFFFAOYSA-N
Molecular Formula C12H10O4
665

Ethyl 7-Hydroxycoumarin-3-carboxylate 98.0+%, TCI America™

CAS: 6093-71-6 Molecular Formula: C12H10O5 Molecular Weight (g/mol): 234.207 MDL Number: MFCD00017641 InChI Key: IETDBZQIWIJQJG-UHFFFAOYSA-N Synonym: 7-Hydroxycoumarin-3-carboxylic Acid Ethyl Ester, Ethyl Umbelliferone-3-carboxylate, Umbelliferone-3-carboxylic Acid Ethyl Ester PubChem CID: 5289613 IUPAC Name: ethyl 7-hydroxy-2-oxochromene-3-carboxylate SMILES: CCOC(=O)C1=CC2=C(C=C(C=C2)O)OC1=O

PubChem CID 5289613
CAS 6093-71-6
Molecular Weight (g/mol) 234.207
MDL Number MFCD00017641
SMILES CCOC(=O)C1=CC2=C(C=C(C=C2)O)OC1=O
Synonym 7-Hydroxycoumarin-3-carboxylic Acid Ethyl Ester, Ethyl Umbelliferone-3-carboxylate, Umbelliferone-3-carboxylic Acid Ethyl Ester
IUPAC Name ethyl 7-hydroxy-2-oxochromene-3-carboxylate
InChI Key IETDBZQIWIJQJG-UHFFFAOYSA-N
Molecular Formula C12H10O5
666

Amyl 4-(4-Ethoxyphenoxycarbonyl)phenyl Carbonate 95.0+%, TCI America™

CAS: 33926-46-4 Molecular Formula: C21H24O6 Molecular Weight (g/mol): 372.42 MDL Number: MFCD00059434 InChI Key: QVUSHDHMLLZBDM-UHFFFAOYSA-N Synonym: 4-(4-Ethoxyphenoxycarbonyl)phenyl Pentyl Carbonate PubChem CID: 578675 IUPAC Name: 4-ethoxyphenyl 4-{[(pentyloxy)carbonyl]oxy}benzoate SMILES: CCCCCOC(=O)OC1=CC=C(C=C1)C(=O)OC1=CC=C(OCC)C=C1

PubChem CID 578675
CAS 33926-46-4
Molecular Weight (g/mol) 372.42
MDL Number MFCD00059434
SMILES CCCCCOC(=O)OC1=CC=C(C=C1)C(=O)OC1=CC=C(OCC)C=C1
Synonym 4-(4-Ethoxyphenoxycarbonyl)phenyl Pentyl Carbonate
IUPAC Name 4-ethoxyphenyl 4-{[(pentyloxy)carbonyl]oxy}benzoate
InChI Key QVUSHDHMLLZBDM-UHFFFAOYSA-N
Molecular Formula C21H24O6
667

3,4-Dihydrocoumarin 98.0+%, TCI America™

CAS: 119-84-6 Molecular Formula: C9H8O2 Molecular Weight (g/mol): 148.161 MDL Number: MFCD00006881 InChI Key: VMUXSMXIQBNMGZ-UHFFFAOYSA-N Synonym: dihydrocoumarin,3,4-dihydrocoumarin,hydrocoumarin,chroman-2-one,benzodihydropyrone,melilotin,melilotol,2-chromanone,1,2-benzodihydropyrone,melilotic lactone PubChem CID: 660 ChEBI: CHEBI:16151 IUPAC Name: 3,4-dihydrochromen-2-one SMILES: C1CC(=O)OC2=CC=CC=C21

PubChem CID 660
CAS 119-84-6
Molecular Weight (g/mol) 148.161
ChEBI CHEBI:16151
MDL Number MFCD00006881
SMILES C1CC(=O)OC2=CC=CC=C21
Synonym dihydrocoumarin,3,4-dihydrocoumarin,hydrocoumarin,chroman-2-one,benzodihydropyrone,melilotin,melilotol,2-chromanone,1,2-benzodihydropyrone,melilotic lactone
IUPAC Name 3,4-dihydrochromen-2-one
InChI Key VMUXSMXIQBNMGZ-UHFFFAOYSA-N
Molecular Formula C9H8O2
668

trans-Cinnamic Acid 98.0+%, TCI America™

CAS: 140-10-3 Molecular Formula: C9H8O2 Molecular Weight (g/mol): 148.161 MDL Number: MFCD00004369 InChI Key: WBYWAXJHAXSJNI-VOTSOKGWSA-N Synonym: cinnamic acid,trans-cinnamic acid,e-cinnamic acid,3-phenylacrylic acid,trans-3-phenylacrylic acid,zimtsaeure,2e-3-phenylprop-2-enoic acid,3-phenylprop-2-enoic acid,3-phenylpropenoic acid PubChem CID: 444539 ChEBI: CHEBI:35697 IUPAC Name: (E)-3-phenylprop-2-enoic acid SMILES: C1=CC=C(C=C1)C=CC(=O)O

PubChem CID 444539
CAS 140-10-3
Molecular Weight (g/mol) 148.161
ChEBI CHEBI:35697
MDL Number MFCD00004369
SMILES C1=CC=C(C=C1)C=CC(=O)O
Synonym cinnamic acid,trans-cinnamic acid,e-cinnamic acid,3-phenylacrylic acid,trans-3-phenylacrylic acid,zimtsaeure,2e-3-phenylprop-2-enoic acid,3-phenylprop-2-enoic acid,3-phenylpropenoic acid
IUPAC Name (E)-3-phenylprop-2-enoic acid
InChI Key WBYWAXJHAXSJNI-VOTSOKGWSA-N
Molecular Formula C9H8O2
669

trans-Cinnamamide 98.0+%, TCI America™

CAS: 22031-64-7 Molecular Formula: C9H9NO Molecular Weight (g/mol): 147.177 MDL Number: MFCD00008033 InChI Key: APEJMQOBVMLION-VOTSOKGWSA-N Synonym: trans-3-Phenylacrylamide PubChem CID: 5273472 ChEBI: CHEBI:76320 IUPAC Name: (E)-3-phenylprop-2-enamide SMILES: C1=CC=C(C=C1)C=CC(=O)N

PubChem CID 5273472
CAS 22031-64-7
Molecular Weight (g/mol) 147.177
ChEBI CHEBI:76320
MDL Number MFCD00008033
SMILES C1=CC=C(C=C1)C=CC(=O)N
Synonym trans-3-Phenylacrylamide
IUPAC Name (E)-3-phenylprop-2-enamide
InChI Key APEJMQOBVMLION-VOTSOKGWSA-N
Molecular Formula C9H9NO
670

(E)-4-Aminocinnamic Acid 98.0+%, TCI America™

CAS: 17570-30-8 Molecular Formula: C9H9NO2 Molecular Weight (g/mol): 163.176 MDL Number: MFCD00017117 InChI Key: JOLPMPPNHIACPD-ZZXKWVIFSA-N Synonym: (E)-3-(4-Aminophenyl)acrylic Acid PubChem CID: 1549514 IUPAC Name: (E)-3-(4-aminophenyl)prop-2-enoic acid SMILES: C1=CC(=CC=C1C=CC(=O)O)N

PubChem CID 1549514
CAS 17570-30-8
Molecular Weight (g/mol) 163.176
MDL Number MFCD00017117
SMILES C1=CC(=CC=C1C=CC(=O)O)N
Synonym (E)-3-(4-Aminophenyl)acrylic Acid
IUPAC Name (E)-3-(4-aminophenyl)prop-2-enoic acid
InChI Key JOLPMPPNHIACPD-ZZXKWVIFSA-N
Molecular Formula C9H9NO2
671

Bis[rhodium(alpha,alpha,alpha',alpha'-tetramethyl-1,3-benzenedipropionic Acid)] 96.0+%, TCI America™

CAS: 819050-89-0 Molecular Formula: C32H40O8Rh2 Molecular Weight (g/mol): 758.48 MDL Number: MFCD08457636 InChI Key: AHCPGXZDVSBJII-UHFFFAOYSA-J Synonym: Rh2(esp)2 PubChem CID: 131885550 IUPAC Name: bis(λ²-rhodium(2+)) bis(3-[3-(2-carboxylato-2,2-dimethylethyl)phenyl]-2,2-dimethylpropanoate) SMILES: [Rh++].[Rh++].CC(C)(CC1=CC(CC(C)(C)C([O-])=O)=CC=C1)C([O-])=O.CC(C)(CC1=CC(CC(C)(C)C([O-])=O)=CC=C1)C([O-])=O

PubChem CID 131885550
CAS 819050-89-0
Molecular Weight (g/mol) 758.48
MDL Number MFCD08457636
SMILES [Rh++].[Rh++].CC(C)(CC1=CC(CC(C)(C)C([O-])=O)=CC=C1)C([O-])=O.CC(C)(CC1=CC(CC(C)(C)C([O-])=O)=CC=C1)C([O-])=O
Synonym Rh2(esp)2
IUPAC Name bis(λ²-rhodium(2+)) bis(3-[3-(2-carboxylato-2,2-dimethylethyl)phenyl]-2,2-dimethylpropanoate)
InChI Key AHCPGXZDVSBJII-UHFFFAOYSA-J
Molecular Formula C32H40O8Rh2
672

3-(3,4-Dihydroxyphenyl)-2-methyl-L-alanine Sesquihydrate 98.0+%, TCI America™

CAS: 555-30-6 Molecular Formula: C10H13NO4 Molecular Weight (g/mol): 211.217 MDL Number: MFCD00004186 InChI Key: CJCSPKMFHVPWAR-JTQLQIEISA-N Synonym: methyldopa,alphamethyldopa,aldomet,alpha medopa,dopamet,l-alpha-methyldopa,alpha-methyl dopa,baypresol,hyperpax,presolisin PubChem CID: 38853 ChEBI: CHEBI:61058 IUPAC Name: (2S)-2-amino-3-(3,4-dihydroxyphenyl)-2-methylpropanoic acid SMILES: CC(CC1=CC(=C(C=C1)O)O)(C(=O)O)N

PubChem CID 38853
CAS 555-30-6
Molecular Weight (g/mol) 211.217
ChEBI CHEBI:61058
MDL Number MFCD00004186
SMILES CC(CC1=CC(=C(C=C1)O)O)(C(=O)O)N
Synonym methyldopa,alphamethyldopa,aldomet,alpha medopa,dopamet,l-alpha-methyldopa,alpha-methyl dopa,baypresol,hyperpax,presolisin
IUPAC Name (2S)-2-amino-3-(3,4-dihydroxyphenyl)-2-methylpropanoic acid
InChI Key CJCSPKMFHVPWAR-JTQLQIEISA-N
Molecular Formula C10H13NO4
673

Curcumin (0.1% in ca. 95% Ethanol), TCI America™

CAS: 458-37-7 Molecular Formula: C21H20O6 Molecular Weight (g/mol): 368.39 MDL Number: MFCD00008365 InChI Key: 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,4Z,6E)-5-hydroxy-1,7-bis(4-hydroxy-3-methoxyphenyl)hepta-1,4,6-trien-3-one SMILES: COC1=CC(\C=C\C(\O)=C\C(=O)\C=C\C2=CC=C(O)C(OC)=C2)=CC=C1O

PubChem CID 969516
CAS 458-37-7
Molecular Weight (g/mol) 368.39
ChEBI CHEBI:3962
MDL Number MFCD00008365
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
IUPAC Name (1E,4Z,6E)-5-hydroxy-1,7-bis(4-hydroxy-3-methoxyphenyl)hepta-1,4,6-trien-3-one
InChI Key ZIUSSTSXXLLKKK-KOBPDPAPSA-N
Molecular Formula C21H20O6
674

alpha-Cyanocinnamic Acid 98.0+%, TCI America™

CAS: 1011-92-3 Molecular Formula: C10H7NO2 Molecular Weight (g/mol): 173.171 MDL Number: MFCD00016813 InChI Key: CDUQMGQIHYISOP-UHFFFAOYSA-N Synonym: 2-cyano-3-phenylacrylic acid,alpha-cyanocinnamicacid,cyanocinnamic acid,2-cyano-3-phenyl-2-propenoic acid,acmc-1b4v0,a-cyano-b-phenylacrylic acid,alpha-cyano-beta-phenyl-acrylic acid PubChem CID: 70534 IUPAC Name: 2-cyano-3-phenylprop-2-enoic acid SMILES: C1=CC=C(C=C1)C=C(C#N)C(=O)O

PubChem CID 70534
CAS 1011-92-3
Molecular Weight (g/mol) 173.171
MDL Number MFCD00016813
SMILES C1=CC=C(C=C1)C=C(C#N)C(=O)O
Synonym 2-cyano-3-phenylacrylic acid,alpha-cyanocinnamicacid,cyanocinnamic acid,2-cyano-3-phenyl-2-propenoic acid,acmc-1b4v0,a-cyano-b-phenylacrylic acid,alpha-cyano-beta-phenyl-acrylic acid
IUPAC Name 2-cyano-3-phenylprop-2-enoic acid
InChI Key CDUQMGQIHYISOP-UHFFFAOYSA-N
Molecular Formula C10H7NO2
675

Carbidopa Monohydrate 98.0+%, TCI America™

CAS: 38821-49-7 Molecular Formula: C10H16N2O5 Molecular Weight (g/mol): 244.247 MDL Number: MFCD00889211 InChI Key: QTAOMKOIBXZKND-PPHPATTJSA-N Synonym: 3-3,4-dihydroxyphenyl-2-hydrazinyl-2-methylpropanoic acid hydrate,+-2-3,4-dihydroxybenzyl-2-hydrazinopropionic acid monohydrate,3-3,4-bis oxidanyl phenyl-2-diazanyl-2-methyl-propanoic acid hydrate PubChem CID: 38101 ChEBI: CHEBI:3395 IUPAC Name: (2S)-3-(3,4-dihydroxyphenyl)-2-hydrazinyl-2-methylpropanoic acid;hydrate SMILES: CC(CC1=CC(=C(C=C1)O)O)(C(=O)O)NN.O

PubChem CID 38101
CAS 38821-49-7
Molecular Weight (g/mol) 244.247
ChEBI CHEBI:3395
MDL Number MFCD00889211
SMILES CC(CC1=CC(=C(C=C1)O)O)(C(=O)O)NN.O
Synonym 3-3,4-dihydroxyphenyl-2-hydrazinyl-2-methylpropanoic acid hydrate,+-2-3,4-dihydroxybenzyl-2-hydrazinopropionic acid monohydrate,3-3,4-bis oxidanyl phenyl-2-diazanyl-2-methyl-propanoic acid hydrate
IUPAC Name (2S)-3-(3,4-dihydroxyphenyl)-2-hydrazinyl-2-methylpropanoic acid;hydrate
InChI Key QTAOMKOIBXZKND-PPHPATTJSA-N
Molecular Formula C10H16N2O5