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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

3',4',5,7-Tetrahydroxyflavone 98.0+%, TCI America™

CAS: 491-70-3 Molecular Formula: C15H10O6 Molecular Weight (g/mol): 286.239 MDL Number: MFCD00017309 InChI Key: IQPNAANSBPBGFQ-UHFFFAOYSA-N Synonym: luteolin,3',4',5,7-tetrahydroxyflavone,2-3,4-dihydroxyphenyl-5,7-dihydroxy-4h-chromen-4-one,digitoflavone,luteolol,flacitran,luteoline,weld lake,cyanidenon 1470,salifazide PubChem CID: 5280445 ChEBI: CHEBI:15864 IUPAC Name: 2-(3,4-dihydroxyphenyl)-5,7-dihydroxychromen-4-one SMILES: C1=CC(=C(C=C1C2=CC(=O)C3=C(C=C(C=C3O2)O)O)O)O

PubChem CID 5280445
CAS 491-70-3
Molecular Weight (g/mol) 286.239
ChEBI CHEBI:15864
MDL Number MFCD00017309
SMILES C1=CC(=C(C=C1C2=CC(=O)C3=C(C=C(C=C3O2)O)O)O)O
Synonym luteolin,3',4',5,7-tetrahydroxyflavone,2-3,4-dihydroxyphenyl-5,7-dihydroxy-4h-chromen-4-one,digitoflavone,luteolol,flacitran,luteoline,weld lake,cyanidenon 1470,salifazide
IUPAC Name 2-(3,4-dihydroxyphenyl)-5,7-dihydroxychromen-4-one
InChI Key IQPNAANSBPBGFQ-UHFFFAOYSA-N
Molecular Formula C15H10O6
662

Daidzein 98.0+%, TCI America™

CAS: 486-66-8 Molecular Formula: C15H10O4 Molecular Weight (g/mol): 254.241 MDL Number: MFCD00016954 InChI Key: ZQSIJRDFPHDXIC-UHFFFAOYSA-N Synonym: daidzein,4',7-dihydroxyisoflavone,daidzeol,7,4'-dihydroxyisoflavone,7-hydroxy-3-4-hydroxyphenyl-4h-chromen-4-one,diadzein,7-hydroxy-3-4-hydroxyphenyl-4h-1-benzopyran-4-one,4h-1-benzopyran-4-one, 7-hydroxy-3-4-hydroxyphenyl,7-hydroxy-3-4-hydroxyphenyl chromen-4-one,7-hydroxy-3-4-hydroxyphenyl-4-benzopyrone PubChem CID: 5281708 ChEBI: CHEBI:28197 IUPAC Name: 7-hydroxy-3-(4-hydroxyphenyl)chromen-4-one SMILES: C1=CC(=CC=C1C2=COC3=C(C2=O)C=CC(=C3)O)O

PubChem CID 5281708
CAS 486-66-8
Molecular Weight (g/mol) 254.241
ChEBI CHEBI:28197
MDL Number MFCD00016954
SMILES C1=CC(=CC=C1C2=COC3=C(C2=O)C=CC(=C3)O)O
Synonym daidzein,4',7-dihydroxyisoflavone,daidzeol,7,4'-dihydroxyisoflavone,7-hydroxy-3-4-hydroxyphenyl-4h-chromen-4-one,diadzein,7-hydroxy-3-4-hydroxyphenyl-4h-1-benzopyran-4-one,4h-1-benzopyran-4-one, 7-hydroxy-3-4-hydroxyphenyl,7-hydroxy-3-4-hydroxyphenyl chromen-4-one,7-hydroxy-3-4-hydroxyphenyl-4-benzopyrone
IUPAC Name 7-hydroxy-3-(4-hydroxyphenyl)chromen-4-one
InChI Key ZQSIJRDFPHDXIC-UHFFFAOYSA-N
Molecular Formula C15H10O4
663

Apigenin 98.0+%, TCI America™

CAS: 520-36-5 Molecular Formula: C15H10O5 Molecular Weight (g/mol): 270.24 MDL Number: MFCD00006831 InChI Key: KZNIFHPLKGYRTM-UHFFFAOYSA-N Synonym: apigenin,5,7-dihydroxy-2-4-hydroxyphenyl-4h-chromen-4-one,chamomile,spigenin,versulin,apigenol,4',5,7-trihydroxyflavone,apigenine,c.i. natural yellow 1,5,7,4'-trihydroxyflavone PubChem CID: 5280443 ChEBI: CHEBI:18388 IUPAC Name: 5,7-dihydroxy-2-(4-hydroxyphenyl)-4H-chromen-4-one SMILES: OC1=CC=C(C=C1)C1=CC(=O)C2=C(O)C=C(O)C=C2O1

PubChem CID 5280443
CAS 520-36-5
Molecular Weight (g/mol) 270.24
ChEBI CHEBI:18388
MDL Number MFCD00006831
SMILES OC1=CC=C(C=C1)C1=CC(=O)C2=C(O)C=C(O)C=C2O1
Synonym apigenin,5,7-dihydroxy-2-4-hydroxyphenyl-4h-chromen-4-one,chamomile,spigenin,versulin,apigenol,4',5,7-trihydroxyflavone,apigenine,c.i. natural yellow 1,5,7,4'-trihydroxyflavone
IUPAC Name 5,7-dihydroxy-2-(4-hydroxyphenyl)-4H-chromen-4-one
InChI Key KZNIFHPLKGYRTM-UHFFFAOYSA-N
Molecular Formula C15H10O5
664

3-(4-Methoxyphenyl)propionic Acid 98.0+%, TCI America™

CAS: 1929-29-9 Molecular Formula: C10H12O3 Molecular Weight (g/mol): 180.203 MDL Number: MFCD00002777 InChI Key: FIUFLISGGHNPSM-UHFFFAOYSA-N Synonym: 3-4-methoxyphenyl propanoic acid,3-4-methoxyphenyl propionic acid,benzenepropanoic acid, 4-methoxy,p-methoxyhydrocinnamic acid,3-p-methoxyphenyl propionic acid,3-4-methoxy-phenyl-propionic acid,4-methoxyhydrocinnamic acid,3-4-methoxyphenyl-propionic acid,4-methoxyhydro cinnamic acid,hydrocinnamic acid, p-methoxy PubChem CID: 95750 IUPAC Name: 3-(4-methoxyphenyl)propanoic acid SMILES: COC1=CC=C(C=C1)CCC(=O)O

PubChem CID 95750
CAS 1929-29-9
Molecular Weight (g/mol) 180.203
MDL Number MFCD00002777
SMILES COC1=CC=C(C=C1)CCC(=O)O
Synonym 3-4-methoxyphenyl propanoic acid,3-4-methoxyphenyl propionic acid,benzenepropanoic acid, 4-methoxy,p-methoxyhydrocinnamic acid,3-p-methoxyphenyl propionic acid,3-4-methoxy-phenyl-propionic acid,4-methoxyhydrocinnamic acid,3-4-methoxyphenyl-propionic acid,4-methoxyhydro cinnamic acid,hydrocinnamic acid, p-methoxy
IUPAC Name 3-(4-methoxyphenyl)propanoic acid
InChI Key FIUFLISGGHNPSM-UHFFFAOYSA-N
Molecular Formula C10H12O3
665

2,3-Dibromo-3-phenylpropionic Acid 98.0+%, TCI America™

CAS: 6286-30-2 Molecular Formula: C9H8Br2O2 Molecular Weight (g/mol): 307.97 MDL Number: MFCD00004208 InChI Key: FXJWTHBNVZNQQP-UHFFFAOYNA-N Synonym: alpha,beta-Dibromohydrocinnamic Acid PubChem CID: 22705 IUPAC Name: 2,3-dibromo-3-phenylpropanoic acid SMILES: OC(=O)C(Br)C(Br)C1=CC=CC=C1

PubChem CID 22705
CAS 6286-30-2
Molecular Weight (g/mol) 307.97
MDL Number MFCD00004208
SMILES OC(=O)C(Br)C(Br)C1=CC=CC=C1
Synonym alpha,beta-Dibromohydrocinnamic Acid
IUPAC Name 2,3-dibromo-3-phenylpropanoic acid
InChI Key FXJWTHBNVZNQQP-UHFFFAOYNA-N
Molecular Formula C9H8Br2O2
666

alpha,alpha,alpha',alpha'-Tetramethyl-1,3-benzenedipropionic Acid 98.0+%, TCI America™

CAS: 819050-88-9 Molecular Formula: C16H22O4 Molecular Weight (g/mol): 278.35 MDL Number: MFCD08276874 InChI Key: BZWQVGTVYGEXTE-UHFFFAOYSA-N Synonym: 3,3′-(1,3-Phenylene)bis(2,2-dimethylpropanoic Acid) PubChem CID: 11204982 IUPAC Name: 3-[3-(2-carboxy-2,2-dimethylethyl)phenyl]-2,2-dimethylpropanoic acid SMILES: CC(C)(CC1=CC(CC(C)(C)C(O)=O)=CC=C1)C(O)=O

PubChem CID 11204982
CAS 819050-88-9
Molecular Weight (g/mol) 278.35
MDL Number MFCD08276874
SMILES CC(C)(CC1=CC(CC(C)(C)C(O)=O)=CC=C1)C(O)=O
Synonym 3,3′-(1,3-Phenylene)bis(2,2-dimethylpropanoic Acid)
IUPAC Name 3-[3-(2-carboxy-2,2-dimethylethyl)phenyl]-2,2-dimethylpropanoic acid
InChI Key BZWQVGTVYGEXTE-UHFFFAOYSA-N
Molecular Formula C16H22O4
667

Cetraxate Hydrochloride 98.0+%, TCI America™

CAS: 27724-96-5 Molecular Formula: C17H24ClNO4 Molecular Weight (g/mol): 341.83 MDL Number: MFCD01722166 InChI Key: USROQQUKEBHOFF-UHFFFAOYSA-N Synonym: 3-[4-[[trans-4-(Aminomethyl)cyclohexyl]carbonyloxy]phenyl]propanoic Acid Hydrochloride PubChem CID: 34001 IUPAC Name: hydrogen 3-{4-[4-(aminomethyl)cyclohexanecarbonyloxy]phenyl}propanoic acid chloride SMILES: [H+].[Cl-].NCC1CCC(CC1)C(=O)OC1=CC=C(CCC(O)=O)C=C1

PubChem CID 34001
CAS 27724-96-5
Molecular Weight (g/mol) 341.83
MDL Number MFCD01722166
SMILES [H+].[Cl-].NCC1CCC(CC1)C(=O)OC1=CC=C(CCC(O)=O)C=C1
Synonym 3-[4-[[trans-4-(Aminomethyl)cyclohexyl]carbonyloxy]phenyl]propanoic Acid Hydrochloride
IUPAC Name hydrogen 3-{4-[4-(aminomethyl)cyclohexanecarbonyloxy]phenyl}propanoic acid chloride
InChI Key USROQQUKEBHOFF-UHFFFAOYSA-N
Molecular Formula C17H24ClNO4
668

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
669

3-(3,4-Dimethoxyphenyl)propionic Acid 98.0+%, TCI America™

CAS: 2107-70-2 Molecular Formula: C11H14O4 Molecular Weight (g/mol): 210.229 MDL Number: MFCD00002774 InChI Key: LHHKQWQTBCTDQM-UHFFFAOYSA-N Synonym: 3-3,4-dimethoxyphenyl propionic acid,3-3,4-dimethoxyphenyl propanoic acid,3,4-dimethoxyhydrocinnamic acid,benzenepropanoic acid, 3,4-dimethoxy,3-3,4-dimethoxyphenyl-propionic acid,3-3,4-dimethoxy-phenyl-propionic acid,unii-6xo32zsp1d,6xo32zsp1d,3-3',4'-dimethoxyphenyl propanoic acid,3-3,4-dimethoxyphenyl propionicacid PubChem CID: 75019 ChEBI: CHEBI:44235 IUPAC Name: 3-(3,4-dimethoxyphenyl)propanoic acid SMILES: COC1=C(C=C(C=C1)CCC(=O)O)OC

PubChem CID 75019
CAS 2107-70-2
Molecular Weight (g/mol) 210.229
ChEBI CHEBI:44235
MDL Number MFCD00002774
SMILES COC1=C(C=C(C=C1)CCC(=O)O)OC
Synonym 3-3,4-dimethoxyphenyl propionic acid,3-3,4-dimethoxyphenyl propanoic acid,3,4-dimethoxyhydrocinnamic acid,benzenepropanoic acid, 3,4-dimethoxy,3-3,4-dimethoxyphenyl-propionic acid,3-3,4-dimethoxy-phenyl-propionic acid,unii-6xo32zsp1d,6xo32zsp1d,3-3',4'-dimethoxyphenyl propanoic acid,3-3,4-dimethoxyphenyl propionicacid
IUPAC Name 3-(3,4-dimethoxyphenyl)propanoic acid
InChI Key LHHKQWQTBCTDQM-UHFFFAOYSA-N
Molecular Formula C11H14O4
670

3-[4-(Trifluoromethyl)phenyl]propionic Acid 98.0+%, TCI America™

CAS: 53473-36-2 Molecular Formula: C10H9F3O2 Molecular Weight (g/mol): 218.175 MDL Number: MFCD00674032 InChI Key: OEIUMLSCWINLBB-UHFFFAOYSA-N Synonym: 4-trifluoromethyl hydrocinnamic acid,3-4-trifluoromethyl phenyl propanoic acid,3-4-trifluoromethyl phenyl propionic acid,benzenepropanoic acid, 4-trifluoromethyl,3-4-trifluoromethylphenyl propionic acid,4-trifluoromethyl phenylpropionic acid,p-trifluoromethyl benzylacetic acid,3-4-trifluoromethyl-phenyl-propionic acid PubChem CID: 3588736 IUPAC Name: 3-[4-(trifluoromethyl)phenyl]propanoic acid SMILES: C1=CC(=CC=C1CCC(=O)O)C(F)(F)F

PubChem CID 3588736
CAS 53473-36-2
Molecular Weight (g/mol) 218.175
MDL Number MFCD00674032
SMILES C1=CC(=CC=C1CCC(=O)O)C(F)(F)F
Synonym 4-trifluoromethyl hydrocinnamic acid,3-4-trifluoromethyl phenyl propanoic acid,3-4-trifluoromethyl phenyl propionic acid,benzenepropanoic acid, 4-trifluoromethyl,3-4-trifluoromethylphenyl propionic acid,4-trifluoromethyl phenylpropionic acid,p-trifluoromethyl benzylacetic acid,3-4-trifluoromethyl-phenyl-propionic acid
IUPAC Name 3-[4-(trifluoromethyl)phenyl]propanoic acid
InChI Key OEIUMLSCWINLBB-UHFFFAOYSA-N
Molecular Formula C10H9F3O2
671

(S)-Benzylsuccinic Acid 98.0+%, TCI America™

CAS: 3972-36-9 Molecular Formula: C11H12O4 Molecular Weight (g/mol): 208.213 MDL Number: MFCD00798341 InChI Key: GTOFKXZQQDSVFH-VIFPVBQESA-N PubChem CID: 446168 IUPAC Name: (2S)-2-benzylbutanedioic acid SMILES: C1=CC=C(C=C1)CC(CC(=O)O)C(=O)O

PubChem CID 446168
CAS 3972-36-9
Molecular Weight (g/mol) 208.213
MDL Number MFCD00798341
SMILES C1=CC=C(C=C1)CC(CC(=O)O)C(=O)O
IUPAC Name (2S)-2-benzylbutanedioic acid
InChI Key GTOFKXZQQDSVFH-VIFPVBQESA-N
Molecular Formula C11H12O4
672

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
673

Phenylsuccinic Acid 98.0+%, TCI America™

CAS: 635-51-8 Molecular Formula: C10H10O4 Molecular Weight (g/mol): 194.186 MDL Number: MFCD00004256 InChI Key: LVFFZQQWIZURIO-UHFFFAOYSA-N Synonym: phenylsuccinic acid,dl-phenylsuccinic acid,2-phenylsuccinic acid,phenyl succinic acid,butanedioic acid, phenyl,succinic acid, phenyl,2-phenylsuccinate,.alpha.-phenylsuccinic acid,phenylsuccinate,butanedioic acid, 2-phenyl PubChem CID: 95459 IUPAC Name: 2-phenylbutanedioic acid SMILES: C1=CC=C(C=C1)C(CC(=O)O)C(=O)O

PubChem CID 95459
CAS 635-51-8
Molecular Weight (g/mol) 194.186
MDL Number MFCD00004256
SMILES C1=CC=C(C=C1)C(CC(=O)O)C(=O)O
Synonym phenylsuccinic acid,dl-phenylsuccinic acid,2-phenylsuccinic acid,phenyl succinic acid,butanedioic acid, phenyl,succinic acid, phenyl,2-phenylsuccinate,.alpha.-phenylsuccinic acid,phenylsuccinate,butanedioic acid, 2-phenyl
IUPAC Name 2-phenylbutanedioic acid
InChI Key LVFFZQQWIZURIO-UHFFFAOYSA-N
Molecular Formula C10H10O4
674

7-(Diethylamino)coumarin-3-carboxylic Acid 98.0+%, TCI America™

CAS: 50995-74-9 Molecular Formula: C14H15NO4 Molecular Weight (g/mol): 261.277 MDL Number: MFCD00068721 InChI Key: WHCPTFFIERCDSB-UHFFFAOYSA-N PubChem CID: 659294 IUPAC Name: 7-(diethylamino)-2-oxochromene-3-carboxylic acid SMILES: CCN(CC)C1=CC2=C(C=C1)C=C(C(=O)O2)C(=O)O

PubChem CID 659294
CAS 50995-74-9
Molecular Weight (g/mol) 261.277
MDL Number MFCD00068721
SMILES CCN(CC)C1=CC2=C(C=C1)C=C(C(=O)O2)C(=O)O
IUPAC Name 7-(diethylamino)-2-oxochromene-3-carboxylic acid
InChI Key WHCPTFFIERCDSB-UHFFFAOYSA-N
Molecular Formula C14H15NO4
675

Diosmin 85.0+%, TCI America™

CAS: 520-27-4 Molecular Formula: C28H32O15 Molecular Weight (g/mol): 608.549 MDL Number: MFCD00009772 InChI Key: GZSOSUNBTXMUFQ-YFAPSIMESA-N Synonym: diosmin,barosmin,diosmine,venosmine,diosmil,flebosten,daflon,diosimin,diosminum,tovene PubChem CID: 5281613 ChEBI: CHEBI:4631 IUPAC Name: 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]oxymethyl]oxan-2-yl]oxychromen-4-one SMILES: CC1C(C(C(C(O1)OCC2C(C(C(C(O2)OC3=CC(=C4C(=C3)OC(=CC4=O)C5=CC(=C(C=C5)OC)O)O)O)O)O)O)O)O

PubChem CID 5281613
CAS 520-27-4
Molecular Weight (g/mol) 608.549
ChEBI CHEBI:4631
MDL Number MFCD00009772
SMILES CC1C(C(C(C(O1)OCC2C(C(C(C(O2)OC3=CC(=C4C(=C3)OC(=CC4=O)C5=CC(=C(C=C5)OC)O)O)O)O)O)O)O)O
Synonym diosmin,barosmin,diosmine,venosmine,diosmil,flebosten,daflon,diosimin,diosminum,tovene
IUPAC Name 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]oxymethyl]oxan-2-yl]oxychromen-4-one
InChI Key GZSOSUNBTXMUFQ-YFAPSIMESA-N
Molecular Formula C28H32O15