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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.
Flavonoids (890)
Cinnamic acids and derivatives (865)
Coumarins and derivatives (685)
Linear 1 3-diarylpropanoids (472)
Phenylpropanoic acids (332)
Depsides and depsidones (304)
Isoflavonoids (206)
Cinnamaldehydes (119)
Stilbenes (105)
Macrolide lactams (84)
Anthracyclines (73)
Macrolides and analogues (73)
Tetracyclines (63)
Cinnamyl alcohols (60)
Isocoumarins and derivatives (27)
Macrolactams (22)
Dihydrocoumarins (16)
Neoflavonoids (14)
Ochratoxins and related substances (11)
Angucyclines (1)

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691 – 705 of 3,687 results
691

p-Tolyl Salicylate, TCI America™

CAS: 607-88-5 Molecular Formula: C14H12O3 Molecular Weight (g/mol): 228.247 MDL Number: MFCD00059616 InChI Key: AMYKXJAXRJCLCV-UHFFFAOYSA-N Synonym: p-Cresyl Salicylate, 4-Methylphenyl Salicylate, Salicylic Acid 4-Methylphenyl Ester, Salicylic Acid p-Tolyl Ester PubChem CID: 69091 IUPAC Name: (4-methylphenyl) 2-hydroxybenzoate SMILES: CC1=CC=C(C=C1)OC(=O)C2=CC=CC=C2O

PubChem CID 69091
CAS 607-88-5
Molecular Weight (g/mol) 228.247
MDL Number MFCD00059616
SMILES CC1=CC=C(C=C1)OC(=O)C2=CC=CC=C2O
Synonym p-Cresyl Salicylate, 4-Methylphenyl Salicylate, Salicylic Acid 4-Methylphenyl Ester, Salicylic Acid p-Tolyl Ester
IUPAC Name (4-methylphenyl) 2-hydroxybenzoate
InChI Key AMYKXJAXRJCLCV-UHFFFAOYSA-N
Molecular Formula C14H12O3
692

3-Hydroxyphenyl Benzoate 95.0+%, TCI America™

CAS: 136-36-7 Molecular Formula: C13H10O3 Molecular Weight (g/mol): 214.22 MDL Number: MFCD00020118 InChI Key: GDESWOTWNNGOMW-UHFFFAOYSA-N Synonym: resorcinol monobenzoate,1,3-benzenediol, monobenzoate,eastman inhibitor rmb,resorcinol, monobenzoate,benzoic acid, m-hydroxyphenyl ester,3-benzoyloxyphenol,benzoic acid 3-hydroxyphenyl ester,unii-942e82kuwd,3-hydroxyphenyl benzoate,1,3-benzenediol, 1-benzoate PubChem CID: 8690 IUPAC Name: 3-hydroxyphenyl benzoate SMILES: OC1=CC=CC(OC(=O)C2=CC=CC=C2)=C1

PubChem CID 8690
CAS 136-36-7
Molecular Weight (g/mol) 214.22
MDL Number MFCD00020118
SMILES OC1=CC=CC(OC(=O)C2=CC=CC=C2)=C1
Synonym resorcinol monobenzoate,1,3-benzenediol, monobenzoate,eastman inhibitor rmb,resorcinol, monobenzoate,benzoic acid, m-hydroxyphenyl ester,3-benzoyloxyphenol,benzoic acid 3-hydroxyphenyl ester,unii-942e82kuwd,3-hydroxyphenyl benzoate,1,3-benzenediol, 1-benzoate
IUPAC Name 3-hydroxyphenyl benzoate
InChI Key GDESWOTWNNGOMW-UHFFFAOYSA-N
Molecular Formula C13H10O3
693

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
694

4-Methoxyphenyl 4-(3-Butenyloxy)benzoate 98.0+%, TCI America™

CAS: 76487-56-4 Molecular Formula: C18H18O4 Molecular Weight (g/mol): 298.34 MDL Number: MFCD00143337 InChI Key: CXPLNUIZUUBDCU-UHFFFAOYSA-N Synonym: 4-(3-Butenyloxy)benzoic Acid 4-Methoxyphenyl Ester PubChem CID: 144778 IUPAC Name: 4-methoxyphenyl 4-(but-3-en-1-yloxy)benzoate SMILES: COC1=CC=C(OC(=O)C2=CC=C(OCCC=C)C=C2)C=C1

PubChem CID 144778
CAS 76487-56-4
Molecular Weight (g/mol) 298.34
MDL Number MFCD00143337
SMILES COC1=CC=C(OC(=O)C2=CC=C(OCCC=C)C=C2)C=C1
Synonym 4-(3-Butenyloxy)benzoic Acid 4-Methoxyphenyl Ester
IUPAC Name 4-methoxyphenyl 4-(but-3-en-1-yloxy)benzoate
InChI Key CXPLNUIZUUBDCU-UHFFFAOYSA-N
Molecular Formula C18H18O4
695

Benorilate 98.0+%, TCI America™

CAS: 5003-48-5 Molecular Formula: C17H15NO5 Molecular Weight (g/mol): 313.31 MDL Number: MFCD00864257 InChI Key: FEJKLNWAOXSSNR-UHFFFAOYSA-N Synonym: 4-Acetamidophenyl 2-Acetoxybenzoate, Aspirin Acetaminophen Ester PubChem CID: 21102 IUPAC Name: 4-acetamidophenyl 2-(acetyloxy)benzoate SMILES: CC(=O)NC1=CC=C(OC(=O)C2=CC=CC=C2OC(C)=O)C=C1

PubChem CID 21102
CAS 5003-48-5
Molecular Weight (g/mol) 313.31
MDL Number MFCD00864257
SMILES CC(=O)NC1=CC=C(OC(=O)C2=CC=CC=C2OC(C)=O)C=C1
Synonym 4-Acetamidophenyl 2-Acetoxybenzoate, Aspirin Acetaminophen Ester
IUPAC Name 4-acetamidophenyl 2-(acetyloxy)benzoate
InChI Key FEJKLNWAOXSSNR-UHFFFAOYSA-N
Molecular Formula C17H15NO5
696

4-Chlorophenyl Benzoate 99.0+%, TCI America™

CAS: 8-5-2005 Molecular Formula: C13H9ClO2 Molecular Weight (g/mol): 232.66 MDL Number: MFCD00040854 InChI Key: JKSIXXOEIXUYFW-UHFFFAOYSA-N Synonym: benzoic acid, 4-chlorophenyl ester,p-chlorophenol benzoate,p-chlorophenyl benzoate,benzoic acid 4-chlorophenyl ester,benzoic acid, p-chlorophenyl ester,4-chlorophenylbenzoate,acmc-1cina,cbmicro_005244,4-chlorophenyl benzoate PubChem CID: 347761 IUPAC Name: (4-chlorophenyl) benzoate SMILES: C1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)Cl

PubChem CID 347761
CAS 8-5-2005
Molecular Weight (g/mol) 232.66
MDL Number MFCD00040854
SMILES C1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)Cl
Synonym benzoic acid, 4-chlorophenyl ester,p-chlorophenol benzoate,p-chlorophenyl benzoate,benzoic acid 4-chlorophenyl ester,benzoic acid, p-chlorophenyl ester,4-chlorophenylbenzoate,acmc-1cina,cbmicro_005244,4-chlorophenyl benzoate
IUPAC Name (4-chlorophenyl) benzoate
InChI Key JKSIXXOEIXUYFW-UHFFFAOYSA-N
Molecular Formula C13H9ClO2
697

(E)-Cinnamyl Alcohol 97.0+%, TCI America™

CAS: 4407-36-7 Molecular Formula: C9H10O Molecular Weight (g/mol): 134.178 MDL Number: MFCD00002921 InChI Key: OOCCDEMITAIZTP-QPJJXVBHSA-N Synonym: (E)-3-Phenyl-2-propen-1-ol PubChem CID: 5315892 ChEBI: CHEBI:33227 IUPAC Name: (E)-3-phenylprop-2-en-1-ol SMILES: C1=CC=C(C=C1)C=CCO

PubChem CID 5315892
CAS 4407-36-7
Molecular Weight (g/mol) 134.178
ChEBI CHEBI:33227
MDL Number MFCD00002921
SMILES C1=CC=C(C=C1)C=CCO
Synonym (E)-3-Phenyl-2-propen-1-ol
IUPAC Name (E)-3-phenylprop-2-en-1-ol
InChI Key OOCCDEMITAIZTP-QPJJXVBHSA-N
Molecular Formula C9H10O
698

Montelukast Sodium Hydrate 98.0+%, TCI America™

CAS: 151767-02-1 Molecular Formula: C35H35ClNNaO3S Molecular Weight (g/mol): 608.17 MDL Number: MFCD00931431 InChI Key: LBFBRXGCXUHRJY-HKHDRNBDSA-M Synonym: montelukast sodium,singulair,montair,unii-u1o3j18sfl,montelukast sodium usan,montelukast na,montelukast sodium salt,u1o3j18sfl,singulair tn PubChem CID: 23663996 ChEBI: CHEBI:6993 IUPAC Name: sodium 2-[1-({[(1R)-1-{3-[(1E)-2-(7-chloroquinolin-2-yl)ethenyl]phenyl}-3-[2-(2-hydroxypropan-2-yl)phenyl]propyl]sulfanyl}methyl)cyclopropyl]acetate SMILES: [Na+].CC(C)(O)C1=CC=CC=C1CC[C@@H](SCC1(CC([O-])=O)CC1)C1=CC=CC(\C=C\C2=CC=C3C=CC(Cl)=CC3=N2)=C1

PubChem CID 23663996
CAS 151767-02-1
Molecular Weight (g/mol) 608.17
ChEBI CHEBI:6993
MDL Number MFCD00931431
SMILES [Na+].CC(C)(O)C1=CC=CC=C1CC[C@@H](SCC1(CC([O-])=O)CC1)C1=CC=CC(\C=C\C2=CC=C3C=CC(Cl)=CC3=N2)=C1
Synonym montelukast sodium,singulair,montair,unii-u1o3j18sfl,montelukast sodium usan,montelukast na,montelukast sodium salt,u1o3j18sfl,singulair tn
IUPAC Name sodium 2-[1-({[(1R)-1-{3-[(1E)-2-(7-chloroquinolin-2-yl)ethenyl]phenyl}-3-[2-(2-hydroxypropan-2-yl)phenyl]propyl]sulfanyl}methyl)cyclopropyl]acetate
InChI Key LBFBRXGCXUHRJY-HKHDRNBDSA-M
Molecular Formula C35H35ClNNaO3S
699

Phlorizin Hydrate 97.0+%, TCI America™

CAS: 60-81-1 Molecular Formula: C21H24O10 Molecular Weight (g/mol): 436.413 MDL Number: MFCD00006591 InChI Key: IOUVKUPGCMBWBT-QNDFHXLGSA-N Synonym: phlorizin,phloridzin,phlorhizin,phlorizoside,floridzin,phlorrhizin,phloretin 2'-glucoside,phloridzosid,phlorrhizen,phlorizine PubChem CID: 6072 ChEBI: CHEBI:8113 IUPAC Name: 1-[2,4-dihydroxy-6-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]-3-(4-hydroxyphenyl)propan-1-one SMILES: C1=CC(=CC=C1CCC(=O)C2=C(C=C(C=C2OC3C(C(C(C(O3)CO)O)O)O)O)O)O

PubChem CID 6072
CAS 60-81-1
Molecular Weight (g/mol) 436.413
ChEBI CHEBI:8113
MDL Number MFCD00006591
SMILES C1=CC(=CC=C1CCC(=O)C2=C(C=C(C=C2OC3C(C(C(C(O3)CO)O)O)O)O)O)O
Synonym phlorizin,phloridzin,phlorhizin,phlorizoside,floridzin,phlorrhizin,phloretin 2'-glucoside,phloridzosid,phlorrhizen,phlorizine
IUPAC Name 1-[2,4-dihydroxy-6-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]-3-(4-hydroxyphenyl)propan-1-one
InChI Key IOUVKUPGCMBWBT-QNDFHXLGSA-N
Molecular Formula C21H24O10
700

4'-Chlorochalcone 98.0+%, TCI America™

CAS: 956-02-5 Molecular Formula: C15H11ClO Molecular Weight (g/mol): 242.702 MDL Number: MFCD00016343 InChI Key: HIINIOLNGCQCSM-IZZDOVSWSA-N Synonym: 4'-chlorochalcone,1-4-chlorophenyl-3-phenylprop-2-en-1-one,2e-1-4-chlorophenyl-3-phenylprop-2-en-1-one,e-1-4-chlorophenyl-3-phenylprop-2-en-1-one,chalcone, 4'-chloro,2-propen-1-one, 1-4-chlorophenyl-3-phenyl,ketone, p-chlorophenyl styryl,benzylidene p-chloroacetophenone,4'-chlorchalkon,e-4'-chlorochalcone PubChem CID: 5377008 IUPAC Name: (E)-1-(4-chlorophenyl)-3-phenylprop-2-en-1-one SMILES: C1=CC=C(C=C1)C=CC(=O)C2=CC=C(C=C2)Cl

PubChem CID 5377008
CAS 956-02-5
Molecular Weight (g/mol) 242.702
MDL Number MFCD00016343
SMILES C1=CC=C(C=C1)C=CC(=O)C2=CC=C(C=C2)Cl
Synonym 4'-chlorochalcone,1-4-chlorophenyl-3-phenylprop-2-en-1-one,2e-1-4-chlorophenyl-3-phenylprop-2-en-1-one,e-1-4-chlorophenyl-3-phenylprop-2-en-1-one,chalcone, 4'-chloro,2-propen-1-one, 1-4-chlorophenyl-3-phenyl,ketone, p-chlorophenyl styryl,benzylidene p-chloroacetophenone,4'-chlorchalkon,e-4'-chlorochalcone
IUPAC Name (E)-1-(4-chlorophenyl)-3-phenylprop-2-en-1-one
InChI Key HIINIOLNGCQCSM-IZZDOVSWSA-N
Molecular Formula C15H11ClO
701

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
702

4-Aminohydrocinnamic Acid 98.0+%, TCI America™

CAS: 2393-17-1 Molecular Formula: C9H11NO2 Molecular Weight (g/mol): 165.192 MDL Number: MFCD00017118 InChI Key: WXOHKMNWMKZMND-UHFFFAOYSA-N Synonym: 3-4-aminophenyl propionic acid,3-4-aminophenyl propanoic acid,4-aminohydrocinnamic acid,benzenepropanoic acid, 4-amino,3-p-aminophenyl propionic acid,beta-p-aminophenyl propionic acid,p-aminohydrocinnamic acid,4-aminobenzenepropanoic acid,benzenepropanoic acid,4-amino,beta-4-aminophenyl propionic acid PubChem CID: 75451 IUPAC Name: 3-(4-aminophenyl)propanoic acid SMILES: C1=CC(=CC=C1CCC(=O)O)N

PubChem CID 75451
CAS 2393-17-1
Molecular Weight (g/mol) 165.192
MDL Number MFCD00017118
SMILES C1=CC(=CC=C1CCC(=O)O)N
Synonym 3-4-aminophenyl propionic acid,3-4-aminophenyl propanoic acid,4-aminohydrocinnamic acid,benzenepropanoic acid, 4-amino,3-p-aminophenyl propionic acid,beta-p-aminophenyl propionic acid,p-aminohydrocinnamic acid,4-aminobenzenepropanoic acid,benzenepropanoic acid,4-amino,beta-4-aminophenyl propionic acid
IUPAC Name 3-(4-aminophenyl)propanoic acid
InChI Key WXOHKMNWMKZMND-UHFFFAOYSA-N
Molecular Formula C9H11NO2
703

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
704

(R)-(-)-2-Phenylpropionic Acid 98.0+%, TCI America™

CAS: 7782-26-5 Molecular Formula: C9H10O2 Molecular Weight (g/mol): 150.177 MDL Number: MFCD00063140 InChI Key: YPGCWEMNNLXISK-SSDOTTSWSA-N Synonym: r---2-phenylpropionic acid,r-2-phenylpropanoic acid,2r-2-phenylpropanoic acid,r-hydratropic acid,--hydratropic acid,r---hydratropic acid,r---2-phenylpropionicacid,r-2-phenylpropionic acid,r-2-phenyl-propionic acid,r-2-phenyl-proprionic acid PubChem CID: 446626 ChEBI: CHEBI:43035 IUPAC Name: (2R)-2-phenylpropanoic acid SMILES: CC(C1=CC=CC=C1)C(=O)O

PubChem CID 446626
CAS 7782-26-5
Molecular Weight (g/mol) 150.177
ChEBI CHEBI:43035
MDL Number MFCD00063140
SMILES CC(C1=CC=CC=C1)C(=O)O
Synonym r---2-phenylpropionic acid,r-2-phenylpropanoic acid,2r-2-phenylpropanoic acid,r-hydratropic acid,--hydratropic acid,r---hydratropic acid,r---2-phenylpropionicacid,r-2-phenylpropionic acid,r-2-phenyl-propionic acid,r-2-phenyl-proprionic acid
IUPAC Name (2R)-2-phenylpropanoic acid
InChI Key YPGCWEMNNLXISK-SSDOTTSWSA-N
Molecular Formula C9H10O2
705

2-(4-Hydroxyphenyl)propionic Acid 98.0+%, TCI America™

CAS: 938-96-5 Molecular Formula: C9H10O3 Molecular Weight (g/mol): 166.176 MDL Number: MFCD00128847 InChI Key: ZHMMPVANGNPCBW-UHFFFAOYSA-N Synonym: 2-4-hydroxyphenyl propanoic acid,2-4-hydroxyphenyl propionic acid,4-hydroxyhydratropate,4-hydroxyhydratropic acid,4-hydroxyphenyl-2-propionic acid,2-4'-hydroxyphenyl-propionic acid,2-4-hydroxyphenyl propionate,acmc-209ro0,4-hydroxyphenyl propanoic acid,methyl 4-hydroxyphenylacetic acid PubChem CID: 102526 ChEBI: CHEBI:1868 IUPAC Name: 2-(4-hydroxyphenyl)propanoic acid SMILES: CC(C1=CC=C(C=C1)O)C(=O)O

PubChem CID 102526
CAS 938-96-5
Molecular Weight (g/mol) 166.176
ChEBI CHEBI:1868
MDL Number MFCD00128847
SMILES CC(C1=CC=C(C=C1)O)C(=O)O
Synonym 2-4-hydroxyphenyl propanoic acid,2-4-hydroxyphenyl propionic acid,4-hydroxyhydratropate,4-hydroxyhydratropic acid,4-hydroxyphenyl-2-propionic acid,2-4'-hydroxyphenyl-propionic acid,2-4-hydroxyphenyl propionate,acmc-209ro0,4-hydroxyphenyl propanoic acid,methyl 4-hydroxyphenylacetic acid
IUPAC Name 2-(4-hydroxyphenyl)propanoic acid
InChI Key ZHMMPVANGNPCBW-UHFFFAOYSA-N
Molecular Formula C9H10O3