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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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541 – 555 of 3,687 results
541

DL-2-Phenylpropionic Acid 98.0+%, TCI America™

CAS: 492-37-5 Molecular Formula: C9H10O2 Molecular Weight (g/mol): 150.177 MDL Number: MFCD00002650 InChI Key: YPGCWEMNNLXISK-UHFFFAOYSA-N Synonym: 2-phenylpropionic acid,hydratropic acid,dl-2-phenylpropionic acid,alpha-methylphenylacetic acid,2-phenyl-propionic acid,+/--2-phenylpropionic acid,alpha-methylbenzeneacetic acid,benzeneacetic acid, .alpha.-methyl,hydratropasaeure,alpha-phenylpropionic acid PubChem CID: 10296 ChEBI: CHEBI:48526 IUPAC Name: 2-phenylpropanoic acid SMILES: CC(C1=CC=CC=C1)C(=O)O

PubChem CID 10296
CAS 492-37-5
Molecular Weight (g/mol) 150.177
ChEBI CHEBI:48526
MDL Number MFCD00002650
SMILES CC(C1=CC=CC=C1)C(=O)O
Synonym 2-phenylpropionic acid,hydratropic acid,dl-2-phenylpropionic acid,alpha-methylphenylacetic acid,2-phenyl-propionic acid,+/--2-phenylpropionic acid,alpha-methylbenzeneacetic acid,benzeneacetic acid, .alpha.-methyl,hydratropasaeure,alpha-phenylpropionic acid
IUPAC Name 2-phenylpropanoic acid
InChI Key YPGCWEMNNLXISK-UHFFFAOYSA-N
Molecular Formula C9H10O2
542

1,2-Bis(4-methoxyphenyl)-2-oxoethyl Cyclohexylcarbamate 98.0+%, TCI America™

CAS: 196599-80-1 Molecular Formula: C23H27NO5 Molecular Weight (g/mol): 397.471 InChI Key: MTNUOOJIYAKURM-UHFFFAOYSA-N Synonym: Cyclohexylcarbamic Acid 1,2-Bis(4-methoxyphenyl)-2-oxoethyl Ester PubChem CID: 10596958 IUPAC Name: [1,2-bis(4-methoxyphenyl)-2-oxoethyl] N-cyclohexylcarbamate SMILES: COC1=CC=C(C=C1)C(C(=O)C2=CC=C(C=C2)OC)OC(=O)NC3CCCCC3

PubChem CID 10596958
CAS 196599-80-1
Molecular Weight (g/mol) 397.471
SMILES COC1=CC=C(C=C1)C(C(=O)C2=CC=C(C=C2)OC)OC(=O)NC3CCCCC3
Synonym Cyclohexylcarbamic Acid 1,2-Bis(4-methoxyphenyl)-2-oxoethyl Ester
IUPAC Name [1,2-bis(4-methoxyphenyl)-2-oxoethyl] N-cyclohexylcarbamate
InChI Key MTNUOOJIYAKURM-UHFFFAOYSA-N
Molecular Formula C23H27NO5
543

2-(Trifluoromethyl)cinnamic Acid 98.0+%, TCI America™

CAS: 2062-25-1 Molecular Formula: C10H7F3O2 Molecular Weight (g/mol): 216.16 MDL Number: MFCD00004381 InChI Key: AMVYAIXPAGBXOM-AATRIKPKSA-N Synonym: 2-trifluoromethyl cinnamic acid,o-trifluoromethyl cinnamic acid,2-trifluoromethylcinnamic acid,e-3-2-trifluoromethyl phenyl acrylic acid,2e-3-2-trifluoromethyl phenyl prop-2-enoic acid,3-2-trifluoromethyl phenyl acrylic acid,2e-3-2-trifluoroformyl phenyl acrylic acid,e-2-trifluoromethyl cinnamic acid,3-2-trifluoromethyl-phenyl-acrylic acid PubChem CID: 719625 ChEBI: CHEBI:60703 IUPAC Name: (2E)-3-[2-(trifluoromethyl)phenyl]prop-2-enoic acid SMILES: OC(=O)\C=C\C1=CC=CC=C1C(F)(F)F

PubChem CID 719625
CAS 2062-25-1
Molecular Weight (g/mol) 216.16
ChEBI CHEBI:60703
MDL Number MFCD00004381
SMILES OC(=O)\C=C\C1=CC=CC=C1C(F)(F)F
Synonym 2-trifluoromethyl cinnamic acid,o-trifluoromethyl cinnamic acid,2-trifluoromethylcinnamic acid,e-3-2-trifluoromethyl phenyl acrylic acid,2e-3-2-trifluoromethyl phenyl prop-2-enoic acid,3-2-trifluoromethyl phenyl acrylic acid,2e-3-2-trifluoroformyl phenyl acrylic acid,e-2-trifluoromethyl cinnamic acid,3-2-trifluoromethyl-phenyl-acrylic acid
IUPAC Name (2E)-3-[2-(trifluoromethyl)phenyl]prop-2-enoic acid
InChI Key AMVYAIXPAGBXOM-AATRIKPKSA-N
Molecular Formula C10H7F3O2
544

3-(3-Trifluoromethylphenyl)propionic Acid 98.0+%, TCI America™

CAS: 585-50-2 Molecular Formula: C10H9F3O2 Molecular Weight (g/mol): 218.18 MDL Number: MFCD00090487 InChI Key: YLTJJMIWCCJIHI-UHFFFAOYSA-N Synonym: 3-3-trifluoromethyl phenyl propanoic acid,3-3-trifluoromethylphenyl propionic acid,benzenepropanoic acid, 3-trifluoromethyl,3-trifluoromethyl hydrocinnamic acid,unii-4u44xhh79h,3-3'-trifluoromethylphenyl-propionic acid,3-3-trifluoromethyl phenyl propionic acid,cinacalcet m5,m-trifluoromethyl hydrocinnamic acid PubChem CID: 2777683 IUPAC Name: 3-[3-(trifluoromethyl)phenyl]propanoic acid SMILES: OC(=O)CCC1=CC(=CC=C1)C(F)(F)F

PubChem CID 2777683
CAS 585-50-2
Molecular Weight (g/mol) 218.18
MDL Number MFCD00090487
SMILES OC(=O)CCC1=CC(=CC=C1)C(F)(F)F
Synonym 3-3-trifluoromethyl phenyl propanoic acid,3-3-trifluoromethylphenyl propionic acid,benzenepropanoic acid, 3-trifluoromethyl,3-trifluoromethyl hydrocinnamic acid,unii-4u44xhh79h,3-3'-trifluoromethylphenyl-propionic acid,3-3-trifluoromethyl phenyl propionic acid,cinacalcet m5,m-trifluoromethyl hydrocinnamic acid
IUPAC Name 3-[3-(trifluoromethyl)phenyl]propanoic acid
InChI Key YLTJJMIWCCJIHI-UHFFFAOYSA-N
Molecular Formula C10H9F3O2
545

(1E,4E)-1-(4-Hydroxy-3,5-dimethoxyphenyl)-5-(3,4,5-trimethoxyphenyl)-1,4-pentadiene-3-one 95.0+%, TCI America™

CAS: 1217503-60-0 Molecular Formula: C22H24O7 Molecular Weight (g/mol): 400.427 InChI Key: SKZNJIJSGSQNJQ-CDJQDVQCSA-N Synonym: GO-Y078 PubChem CID: 46231908 IUPAC Name: (1E,4E)-1-(4-hydroxy-3,5-dimethoxyphenyl)-5-(3,4,5-trimethoxyphenyl)penta-1,4-dien-3-one SMILES: COC1=CC(=CC(=C1O)OC)C=CC(=O)C=CC2=CC(=C(C(=C2)OC)OC)OC

PubChem CID 46231908
CAS 1217503-60-0
Molecular Weight (g/mol) 400.427
SMILES COC1=CC(=CC(=C1O)OC)C=CC(=O)C=CC2=CC(=C(C(=C2)OC)OC)OC
Synonym GO-Y078
IUPAC Name (1E,4E)-1-(4-hydroxy-3,5-dimethoxyphenyl)-5-(3,4,5-trimethoxyphenyl)penta-1,4-dien-3-one
InChI Key SKZNJIJSGSQNJQ-CDJQDVQCSA-N
Molecular Formula C22H24O7
546

3-Nitrocinnamic Acid 98.0+%, TCI America™

CAS: 555-68-0 Molecular Formula: C9H7NO4 Molecular Weight (g/mol): 193.158 MDL Number: MFCD00007277 InChI Key: WWXMVRYHLZMQIG-SNAWJCMRSA-N Synonym: 3-nitrocinnamic acid,m-nitrocinnamic acid,3-nitro-cinnamic acid,cinnamic acid, m-nitro,trans-3-nitrocinnamic acid,3-nitrobenzenepropenoic acid,e-3-3-nitrophenyl-2-propenoic acid,2e-3-3-nitrophenyl prop-2-enoic acid,2e-3-3-nitrophenyl acrylic acid,unii-z5wu65j930 PubChem CID: 687126 ChEBI: CHEBI:60706 SMILES: C1=CC(=CC(=C1)[N+](=O)[O-])C=CC(=O)O

PubChem CID 687126
CAS 555-68-0
Molecular Weight (g/mol) 193.158
ChEBI CHEBI:60706
MDL Number MFCD00007277
SMILES C1=CC(=CC(=C1)[N+](=O)[O-])C=CC(=O)O
Synonym 3-nitrocinnamic acid,m-nitrocinnamic acid,3-nitro-cinnamic acid,cinnamic acid, m-nitro,trans-3-nitrocinnamic acid,3-nitrobenzenepropenoic acid,e-3-3-nitrophenyl-2-propenoic acid,2e-3-3-nitrophenyl prop-2-enoic acid,2e-3-3-nitrophenyl acrylic acid,unii-z5wu65j930
InChI Key WWXMVRYHLZMQIG-SNAWJCMRSA-N
Molecular Formula C9H7NO4
547

3-Chlorocoumarin 98.0+%, TCI America™

CAS: 92-45-5 Molecular Formula: C9H5ClO2 Molecular Weight (g/mol): 180.59 MDL Number: MFCD00024073 InChI Key: CKCOPMSBJBNBCQ-UHFFFAOYSA-N Synonym: 3-chlorocoumarin,coumarin, 3-chloro,2h-1-benzopyran-2-one, 3-chloro,3-chloro-2h-chromen-2-one,chlorocoumarin,3-chloro-2h-1-benzopyran-2-one,acmc-1ciat,2h-1-benzopyran-2-one,3-chloro PubChem CID: 96133 IUPAC Name: 3-chloro-2H-chromen-2-one SMILES: ClC1=CC2=CC=CC=C2OC1=O

PubChem CID 96133
CAS 92-45-5
Molecular Weight (g/mol) 180.59
MDL Number MFCD00024073
SMILES ClC1=CC2=CC=CC=C2OC1=O
Synonym 3-chlorocoumarin,coumarin, 3-chloro,2h-1-benzopyran-2-one, 3-chloro,3-chloro-2h-chromen-2-one,chlorocoumarin,3-chloro-2h-1-benzopyran-2-one,acmc-1ciat,2h-1-benzopyran-2-one,3-chloro
IUPAC Name 3-chloro-2H-chromen-2-one
InChI Key CKCOPMSBJBNBCQ-UHFFFAOYSA-N
Molecular Formula C9H5ClO2
548

Tyrphostin AG 835 98.0+%, TCI America™

CAS: 133550-37-5 Molecular Formula: C18H16N2O3 Molecular Weight (g/mol): 308.337 MDL Number: MFCD00209855 InChI Key: UMGQVUWXNOJOSJ-CDCQXCROSA-N Synonym: tyrphostin b44, + enantiomer,--r-n-,a-methylbenzyl-3,4-dihydroxybenzylidenecyanoacetamide PubChem CID: 23919058 IUPAC Name: (Z)-2-cyano-3-(3,4-dihydroxyphenyl)-N-[(1R)-1-phenylethyl]prop-2-enamide SMILES: CC(C1=CC=CC=C1)NC(=O)C(=CC2=CC(=C(C=C2)O)O)C#N

PubChem CID 23919058
CAS 133550-37-5
Molecular Weight (g/mol) 308.337
MDL Number MFCD00209855
SMILES CC(C1=CC=CC=C1)NC(=O)C(=CC2=CC(=C(C=C2)O)O)C#N
Synonym tyrphostin b44, + enantiomer,--r-n-,a-methylbenzyl-3,4-dihydroxybenzylidenecyanoacetamide
IUPAC Name (Z)-2-cyano-3-(3,4-dihydroxyphenyl)-N-[(1R)-1-phenylethyl]prop-2-enamide
InChI Key UMGQVUWXNOJOSJ-CDCQXCROSA-N
Molecular Formula C18H16N2O3
549

4-Fluorocinnamic Acid 98.0+%, TCI America™

CAS: 459-32-5 Molecular Formula: C9H7FO2 Molecular Weight (g/mol): 166.151 MDL Number: MFCD00004395 InChI Key: ISMMYAZSUSYVQG-ZZXKWVIFSA-N Synonym: 4-fluorocinnamic acid,e-3-4-fluorophenyl acrylic acid,2e-3-4-fluorophenyl prop-2-enoic acid,p-fluorocinnamic acid,3-4-fluorophenyl acrylic acid,e-p-fluorocinnamic acid,trans-4-fluorocinnamic acid,p-fluoro cinnamic acid,3-4-fluorophenyl prop-2-enoic acid,2-propenoic acid, 3-4-fluorophenyl-, 2e PubChem CID: 1530234 IUPAC Name: (E)-3-(4-fluorophenyl)prop-2-enoic acid SMILES: C1=CC(=CC=C1C=CC(=O)O)F

PubChem CID 1530234
CAS 459-32-5
Molecular Weight (g/mol) 166.151
MDL Number MFCD00004395
SMILES C1=CC(=CC=C1C=CC(=O)O)F
Synonym 4-fluorocinnamic acid,e-3-4-fluorophenyl acrylic acid,2e-3-4-fluorophenyl prop-2-enoic acid,p-fluorocinnamic acid,3-4-fluorophenyl acrylic acid,e-p-fluorocinnamic acid,trans-4-fluorocinnamic acid,p-fluoro cinnamic acid,3-4-fluorophenyl prop-2-enoic acid,2-propenoic acid, 3-4-fluorophenyl-, 2e
IUPAC Name (E)-3-(4-fluorophenyl)prop-2-enoic acid
InChI Key ISMMYAZSUSYVQG-ZZXKWVIFSA-N
Molecular Formula C9H7FO2
550

4-Dimethylaminocinnamaldehyde 98.0+%, TCI America™

CAS: 6203-18-5 Molecular Formula: C11H13NO Molecular Weight (g/mol): 175.231 MDL Number: MFCD00007002 InChI Key: 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

PubChem CID 5284506
CAS 6203-18-5
Molecular Weight (g/mol) 175.231
MDL Number MFCD00007002
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
IUPAC Name (E)-3-[4-(dimethylamino)phenyl]prop-2-enal
InChI Key RUKJCCIJLIMGEP-ONEGZZNKSA-N
Molecular Formula C11H13NO
551

4-Aminophenyl 4-Aminobenzoate 97.0+%, TCI America™

CAS: 20610-77-9 Molecular Formula: C13H12N2O2 Molecular Weight (g/mol): 228.25 MDL Number: MFCD16038468 InChI Key: LOCTYHIHNCOYJZ-UHFFFAOYSA-N Synonym: 4-Aminobenzoic Acid 4-Aminophenyl Ester PubChem CID: 15491725 IUPAC Name: 4-aminophenyl 4-aminobenzoate SMILES: NC1=CC=C(OC(=O)C2=CC=C(N)C=C2)C=C1

PubChem CID 15491725
CAS 20610-77-9
Molecular Weight (g/mol) 228.25
MDL Number MFCD16038468
SMILES NC1=CC=C(OC(=O)C2=CC=C(N)C=C2)C=C1
Synonym 4-Aminobenzoic Acid 4-Aminophenyl Ester
IUPAC Name 4-aminophenyl 4-aminobenzoate
InChI Key LOCTYHIHNCOYJZ-UHFFFAOYSA-N
Molecular Formula C13H12N2O2
552

Coumarin 99.0+%, TCI America™

CAS: 91-64-5 Molecular Formula: C9H6O2 Molecular Weight (g/mol): 146.15 MDL Number: MFCD00006850 InChI Key: ZYGHJZDHTFUPRJ-UHFFFAOYSA-N Synonym: coumarin,2h-chromen-2-one,2h-1-benzopyran-2-one,cumarin,1,2-benzopyrone,rattex,tonka bean camphor,coumarinic anhydride,coumarine,benzo-alpha-pyrone PubChem CID: 323 ChEBI: CHEBI:28794 IUPAC Name: 2H-chromen-2-one SMILES: O=C1OC2=CC=CC=C2C=C1

PubChem CID 323
CAS 91-64-5
Molecular Weight (g/mol) 146.15
ChEBI CHEBI:28794
MDL Number MFCD00006850
SMILES O=C1OC2=CC=CC=C2C=C1
Synonym coumarin,2h-chromen-2-one,2h-1-benzopyran-2-one,cumarin,1,2-benzopyrone,rattex,tonka bean camphor,coumarinic anhydride,coumarine,benzo-alpha-pyrone
IUPAC Name 2H-chromen-2-one
InChI Key ZYGHJZDHTFUPRJ-UHFFFAOYSA-N
Molecular Formula C9H6O2
553

Anisoin 97.0+%, TCI America™

CAS: 119-52-8 Molecular Formula: C16H16O4 Molecular Weight (g/mol): 272.30 MDL Number: MFCD00008411 InChI Key: LRRQSCPPOIUNGX-UHFFFAOYNA-N Synonym: anisoin,2-hydroxy-1,2-bis 4-methoxyphenyl ethanone,4,4'-dimethoxybenzoin,p-anisoin,ethanone, 2-hydroxy-1,2-bis 4-methoxyphenyl,benzoin, 4,4'-dimethoxy,p,p'-dimethoxybenzoin,benzoin,4'-dimethoxy,4,4'-anisoin,1,2-bis 4-methoxyphenyl-2-hydroxyethan-1-one PubChem CID: 95415 IUPAC Name: 2-hydroxy-1,2-bis(4-methoxyphenyl)ethan-1-one SMILES: COC1=CC=C(C=C1)C(O)C(=O)C1=CC=C(OC)C=C1

PubChem CID 95415
CAS 119-52-8
Molecular Weight (g/mol) 272.30
MDL Number MFCD00008411
SMILES COC1=CC=C(C=C1)C(O)C(=O)C1=CC=C(OC)C=C1
Synonym anisoin,2-hydroxy-1,2-bis 4-methoxyphenyl ethanone,4,4'-dimethoxybenzoin,p-anisoin,ethanone, 2-hydroxy-1,2-bis 4-methoxyphenyl,benzoin, 4,4'-dimethoxy,p,p'-dimethoxybenzoin,benzoin,4'-dimethoxy,4,4'-anisoin,1,2-bis 4-methoxyphenyl-2-hydroxyethan-1-one
IUPAC Name 2-hydroxy-1,2-bis(4-methoxyphenyl)ethan-1-one
InChI Key LRRQSCPPOIUNGX-UHFFFAOYNA-N
Molecular Formula C16H16O4
554

Scopoletin 98.0+%, TCI America™

CAS: 92-61-5 Molecular Formula: C10H8O4 Molecular Weight (g/mol): 192.17 MDL Number: MFCD00006872 InChI Key: RODXRVNMMDRFIK-UHFFFAOYSA-N Synonym: scopoletin,gelseminic acid,6-methylesculetin,7-hydroxy-6-methoxy-2h-chromen-2-one,chrysatropic acid,scopoletine,murrayetin,scopoletol,7-hydroxy-6-methoxycoumarin,6-o-methylesculetin PubChem CID: 5280460 ChEBI: CHEBI:17488 IUPAC Name: 7-hydroxy-6-methoxychromen-2-one SMILES: COC1=C(C=C2C(=C1)C=CC(=O)O2)O

PubChem CID 5280460
CAS 92-61-5
Molecular Weight (g/mol) 192.17
ChEBI CHEBI:17488
MDL Number MFCD00006872
SMILES COC1=C(C=C2C(=C1)C=CC(=O)O2)O
Synonym scopoletin,gelseminic acid,6-methylesculetin,7-hydroxy-6-methoxy-2h-chromen-2-one,chrysatropic acid,scopoletine,murrayetin,scopoletol,7-hydroxy-6-methoxycoumarin,6-o-methylesculetin
IUPAC Name 7-hydroxy-6-methoxychromen-2-one
InChI Key RODXRVNMMDRFIK-UHFFFAOYSA-N
Molecular Formula C10H8O4
555

4-Fluorocinnamaldehyde 95.0+%, TCI America™

CAS: 24654-55-5 Molecular Formula: C9H7FO Molecular Weight (g/mol): 150.152 MDL Number: MFCD03425895 InChI Key: YSIYEWBILJZDQH-OWOJBTEDSA-N Synonym: 3-(4-Fluorophenyl)acrylaldehyde, 3-(4-Fluorophenyl)-2-propenal PubChem CID: 11217342 IUPAC Name: (E)-3-(4-fluorophenyl)prop-2-enal SMILES: C1=CC(=CC=C1C=CC=O)F

PubChem CID 11217342
CAS 24654-55-5
Molecular Weight (g/mol) 150.152
MDL Number MFCD03425895
SMILES C1=CC(=CC=C1C=CC=O)F
Synonym 3-(4-Fluorophenyl)acrylaldehyde, 3-(4-Fluorophenyl)-2-propenal
IUPAC Name (E)-3-(4-fluorophenyl)prop-2-enal
InChI Key YSIYEWBILJZDQH-OWOJBTEDSA-N
Molecular Formula C9H7FO