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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 (867)
Cinnamic acids and derivatives (861)
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Linear 1 3-diarylpropanoids (466)
Phenylpropanoic acids (332)
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76 – 90 of 3,626 results
76

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
77

trans-p-Coumaric Acid 98.0+%, TCI America™

CAS: 501-98-4 Molecular Formula: C9H8O3 Molecular Weight (g/mol): 164.16 MDL Number: MFCD00004399 InChI Key: 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-enoic acid SMILES: C1=CC(=CC=C1C=CC(=O)O)O

PubChem CID 637542
CAS 501-98-4
Molecular Weight (g/mol) 164.16
ChEBI CHEBI:32374
MDL Number MFCD00004399
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
IUPAC Name (E)-3-(4-hydroxyphenyl)prop-2-enoic acid
InChI Key NGSWKAQJJWESNS-ZZXKWVIFSA-N
Molecular Formula C9H8O3
78

2,4-Diphenyl-4-methyl-1-pentene 95.0+%, TCI America™

CAS: 6362-80-7 Molecular Formula: C18H20 Molecular Weight (g/mol): 236.36 MDL Number: MFCD00044027 InChI Key: ZOKCNEIWFQCSCM-UHFFFAOYSA-N Synonym: 4-Methyl-2,4-diphenyl-1-pentene PubChem CID: 80715 IUPAC Name: (4-methyl-4-phenylpent-1-en-2-yl)benzene SMILES: CC(C)(CC(=C)C1=CC=CC=C1)C1=CC=CC=C1

PubChem CID 80715
CAS 6362-80-7
Molecular Weight (g/mol) 236.36
MDL Number MFCD00044027
SMILES CC(C)(CC(=C)C1=CC=CC=C1)C1=CC=CC=C1
Synonym 4-Methyl-2,4-diphenyl-1-pentene
IUPAC Name (4-methyl-4-phenylpent-1-en-2-yl)benzene
InChI Key ZOKCNEIWFQCSCM-UHFFFAOYSA-N
Molecular Formula C18H20
79

Ethyl 7-(Diethylamino)coumarin-3-carboxylate 98.0+%, TCI America™

CAS: 28705-46-6 Molecular Formula: C16H19NO4 Molecular Weight (g/mol): 289.331 MDL Number: MFCD00227484 InChI Key: MSOLGAJLRIINNF-UHFFFAOYSA-N Synonym: 7-(Diethylamino)coumarin-3-carboxylic Acid Ethyl Ester PubChem CID: 120014 IUPAC Name: ethyl 7-(diethylamino)-2-oxochromene-3-carboxylate SMILES: CCN(CC)C1=CC2=C(C=C1)C=C(C(=O)O2)C(=O)OCC

PubChem CID 120014
CAS 28705-46-6
Molecular Weight (g/mol) 289.331
MDL Number MFCD00227484
SMILES CCN(CC)C1=CC2=C(C=C1)C=C(C(=O)O2)C(=O)OCC
Synonym 7-(Diethylamino)coumarin-3-carboxylic Acid Ethyl Ester
IUPAC Name ethyl 7-(diethylamino)-2-oxochromene-3-carboxylate
InChI Key MSOLGAJLRIINNF-UHFFFAOYSA-N
Molecular Formula C16H19NO4
80

Piceid 95.0+%, TCI America™

CAS: 27208-80-6 Molecular Formula: C20H22O8 Molecular Weight (g/mol): 390.388 MDL Number: MFCD00210592 InChI Key: HSTZMXCBWJGKHG-CUYWLFDKSA-N PubChem CID: 5281718 ChEBI: CHEBI:8198 IUPAC Name: (2S,3R,4S,5S,6R)-2-[3-hydroxy-5-[(E)-2-(4-hydroxyphenyl)ethenyl]phenoxy]-6-(hydroxymethyl)oxane-3,4,5-triol SMILES: C1=CC(=CC=C1C=CC2=CC(=CC(=C2)OC3C(C(C(C(O3)CO)O)O)O)O)O

PubChem CID 5281718
CAS 27208-80-6
Molecular Weight (g/mol) 390.388
ChEBI CHEBI:8198
MDL Number MFCD00210592
SMILES C1=CC(=CC=C1C=CC2=CC(=CC(=C2)OC3C(C(C(C(O3)CO)O)O)O)O)O
IUPAC Name (2S,3R,4S,5S,6R)-2-[3-hydroxy-5-[(E)-2-(4-hydroxyphenyl)ethenyl]phenoxy]-6-(hydroxymethyl)oxane-3,4,5-triol
InChI Key HSTZMXCBWJGKHG-CUYWLFDKSA-N
Molecular Formula C20H22O8
81

5,7-Dihydroxyflavone, 98%

CAS: 480-40-0 Molecular Formula: C15H10O4 Molecular Weight (g/mol): 254.241 MDL Number: MFCD00006834 InChI Key: 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-one SMILES: C1=CC=C(C=C1)C2=CC(=O)C3=C(C=C(C=C3O2)O)O

PubChem CID 5281607
CAS 480-40-0
Molecular Weight (g/mol) 254.241
ChEBI CHEBI:75095
MDL Number MFCD00006834
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
IUPAC Name 5,7-dihydroxy-2-phenylchromen-4-one
InChI Key RTIXKCRFFJGDFG-UHFFFAOYSA-N
Molecular Formula C15H10O4
82

3,5,7-Trihydroxyflavone, 97%

CAS: 548-83-4 Molecular Formula: C15H10O5 Molecular Weight (g/mol): 270.24 MDL Number: MFCD00006833 InChI Key: VCCRNZQBSJXYJD-UHFFFAOYSA-N Synonym: galangin,norizalpinin,3,5,7-trihydroxyflavone,3,5,7-trihydroxy-2-phenyl-4h-chromen-4-one,3,5,7-trioh-flavone,unii-142fwe6ecs,3,5,7-trihydroxy-2-phenyl-4-benzopyrone,4h-1-benzopyran-4-one, 3,5,7-trihydroxy-2-phenyl,flavone, 3,5,7-trihydroxy,4h-benzopyran-4-one, 3,5,7-trihydroxy-2-phenyl PubChem CID: 5281616 ChEBI: CHEBI:5262 IUPAC Name: 3,5,7-trihydroxy-2-phenylchromen-4-one SMILES: C1=CC=C(C=C1)C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)O

PubChem CID 5281616
CAS 548-83-4
Molecular Weight (g/mol) 270.24
ChEBI CHEBI:5262
MDL Number MFCD00006833
SMILES C1=CC=C(C=C1)C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)O
Synonym galangin,norizalpinin,3,5,7-trihydroxyflavone,3,5,7-trihydroxy-2-phenyl-4h-chromen-4-one,3,5,7-trioh-flavone,unii-142fwe6ecs,3,5,7-trihydroxy-2-phenyl-4-benzopyrone,4h-1-benzopyran-4-one, 3,5,7-trihydroxy-2-phenyl,flavone, 3,5,7-trihydroxy,4h-benzopyran-4-one, 3,5,7-trihydroxy-2-phenyl
IUPAC Name 3,5,7-trihydroxy-2-phenylchromen-4-one
InChI Key VCCRNZQBSJXYJD-UHFFFAOYSA-N
Molecular Formula C15H10O5
83

7,8-Dihydroxyflavone hydrate, 97%

CAS: 38183-03-8 Molecular Formula: C15H10O4 Molecular Weight (g/mol): 254.24 MDL Number: MFCD00006836 InChI Key: COCYGNDCWFKTMF-UHFFFAOYSA-N Synonym: 7,8-dihydroxyflavone,7,8-dihydroxy-2-phenyl-4h-chromen-4-one,7,8-dihydroxy-flavone,4h-1-benzopyran-4-one, 7,8-dihydroxy-2-phenyl,7,8-dhf,7,8-dihydroxy-2-phenyl-4-benzopyrone,7,8-dihydroxy-2-phenyl-chromen-4-one,7,8-dihydroxyflavone hydrate,chembl75267,7,8-dihydroxy-2-phenyl-4h-1-benzopyran-4-one PubChem CID: 1880 IUPAC Name: 7,8-dihydroxy-2-phenylchromen-4-one SMILES: OC1=CC=C2C(=O)C=C(OC2=C1O)C1=CC=CC=C1

PubChem CID 1880
CAS 38183-03-8
Molecular Weight (g/mol) 254.24
MDL Number MFCD00006836
SMILES OC1=CC=C2C(=O)C=C(OC2=C1O)C1=CC=CC=C1
Synonym 7,8-dihydroxyflavone,7,8-dihydroxy-2-phenyl-4h-chromen-4-one,7,8-dihydroxy-flavone,4h-1-benzopyran-4-one, 7,8-dihydroxy-2-phenyl,7,8-dhf,7,8-dihydroxy-2-phenyl-4-benzopyrone,7,8-dihydroxy-2-phenyl-chromen-4-one,7,8-dihydroxyflavone hydrate,chembl75267,7,8-dihydroxy-2-phenyl-4h-1-benzopyran-4-one
IUPAC Name 7,8-dihydroxy-2-phenylchromen-4-one
InChI Key COCYGNDCWFKTMF-UHFFFAOYSA-N
Molecular Formula C15H10O4
84

5,6-Dihydroxyflavone, 97%

CAS: 6665-66-3 Molecular Formula: C15H10O4 Molecular Weight (g/mol): 254.241 MDL Number: MFCD00601534 InChI Key: AGZAGADSYIYYCT-UHFFFAOYSA-N Synonym: 5,6-dihydroxyflavone,5,6-dihydroxy-2-phenyl-4h-chromen-4-one,5,6-dihydroxy-2-phenyl-4h-1-benzopyran-4-one,4h-1-benzopyran-4-one, 5,6-dihydroxy-2-phenyl PubChem CID: 14349487 IUPAC Name: 5,6-dihydroxy-2-phenylchromen-4-one SMILES: C1=CC=C(C=C1)C2=CC(=O)C3=C(O2)C=CC(=C3O)O

PubChem CID 14349487
CAS 6665-66-3
Molecular Weight (g/mol) 254.241
MDL Number MFCD00601534
SMILES C1=CC=C(C=C1)C2=CC(=O)C3=C(O2)C=CC(=C3O)O
Synonym 5,6-dihydroxyflavone,5,6-dihydroxy-2-phenyl-4h-chromen-4-one,5,6-dihydroxy-2-phenyl-4h-1-benzopyran-4-one,4h-1-benzopyran-4-one, 5,6-dihydroxy-2-phenyl
IUPAC Name 5,6-dihydroxy-2-phenylchromen-4-one
InChI Key AGZAGADSYIYYCT-UHFFFAOYSA-N
Molecular Formula C15H10O4
85

5,6,7-Trihydroxyflavone, 97%

CAS: 491-67-8 Molecular Formula: C15H10O5 Molecular Weight (g/mol): 270.24 MDL Number: MFCD00017459 InChI Key: FXNFHKRTJBSTCS-UHFFFAOYSA-N Synonym: baicalein,5,6,7-trihydroxyflavone,noroxylin,5,6,7-trihydroxy-2-phenyl-4h-chromen-4-one,biacalein,baicelein,chembl8260,4h-1-benzopyran-4-one, 5,6,7-trihydroxy-2-phenyl,5,7-trihydroxyflavone,5,6,7-trihydroxy-2-phenyl-chromen-4-one PubChem CID: 5281605 ChEBI: CHEBI:2979 IUPAC Name: 5,6,7-trihydroxy-2-phenylchromen-4-one SMILES: OC1=C(O)C(O)=C2C(=O)C=C(OC2=C1)C1=CC=CC=C1

PubChem CID 5281605
CAS 491-67-8
Molecular Weight (g/mol) 270.24
ChEBI CHEBI:2979
MDL Number MFCD00017459
SMILES OC1=C(O)C(O)=C2C(=O)C=C(OC2=C1)C1=CC=CC=C1
Synonym baicalein,5,6,7-trihydroxyflavone,noroxylin,5,6,7-trihydroxy-2-phenyl-4h-chromen-4-one,biacalein,baicelein,chembl8260,4h-1-benzopyran-4-one, 5,6,7-trihydroxy-2-phenyl,5,7-trihydroxyflavone,5,6,7-trihydroxy-2-phenyl-chromen-4-one
IUPAC Name 5,6,7-trihydroxy-2-phenylchromen-4-one
InChI Key FXNFHKRTJBSTCS-UHFFFAOYSA-N
Molecular Formula C15H10O5
86

Quercetin, Dihydrate, Spectrum™ Chemical
SDP

CAS: 6151-25-3

CAS 6151-25-3
87

3',4',7,8-Tetramethoxyflavone, 97%

CAS: 65548-55-2 Molecular Formula: C19H18O6 Molecular Weight (g/mol): 342.347 MDL Number: MFCD00143001 InChI Key: ZRLWYUNKZNRQLO-UHFFFAOYSA-N Synonym: 3',4',7,8-tetramethoxyflavone,2-3,4-dimethoxyphenyl-7,8-dimethoxy-4h-chromen-4-one,2-3,4-dimethoxyphenyl-7,8-dimethoxychromen-4-one,4h-1-benzopyran-4-one, 2-3,4-dimethoxyphenyl-7,8-dimethoxy,2-3,4-dimethoxy-phenyl-7,8-dimethoxy-chromen-4-one,acmc-1b8pz,7,8,3',4'-tetramethoxyflavone,7,8-dimethoxy-2-3,4-dimethoxyphenyl-4h-chromen-4-one PubChem CID: 4033898 IUPAC Name: 2-(3,4-dimethoxyphenyl)-7,8-dimethoxychromen-4-one SMILES: COC1=C(C=C(C=C1)C2=CC(=O)C3=C(O2)C(=C(C=C3)OC)OC)OC

PubChem CID 4033898
CAS 65548-55-2
Molecular Weight (g/mol) 342.347
MDL Number MFCD00143001
SMILES COC1=C(C=C(C=C1)C2=CC(=O)C3=C(O2)C(=C(C=C3)OC)OC)OC
Synonym 3',4',7,8-tetramethoxyflavone,2-3,4-dimethoxyphenyl-7,8-dimethoxy-4h-chromen-4-one,2-3,4-dimethoxyphenyl-7,8-dimethoxychromen-4-one,4h-1-benzopyran-4-one, 2-3,4-dimethoxyphenyl-7,8-dimethoxy,2-3,4-dimethoxy-phenyl-7,8-dimethoxy-chromen-4-one,acmc-1b8pz,7,8,3',4'-tetramethoxyflavone,7,8-dimethoxy-2-3,4-dimethoxyphenyl-4h-chromen-4-one
IUPAC Name 2-(3,4-dimethoxyphenyl)-7,8-dimethoxychromen-4-one
InChI Key ZRLWYUNKZNRQLO-UHFFFAOYSA-N
Molecular Formula C19H18O6
88

4',5,7-Trihydroxyflavone, 97%

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)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)chromen-4-one
InChI Key KZNIFHPLKGYRTM-UHFFFAOYSA-N
Molecular Formula C15H10O5
89

4'-Hydroxy-6-methylflavone, 97%

CAS: 288401-04-7 Molecular Formula: C16H12O3 Molecular Weight (g/mol): 252.269 MDL Number: MFCD03424432 InChI Key: YAACYYNCHMHECD-UHFFFAOYSA-N Synonym: 4'-hydroxy-6-methylflavone,2-4-hydroxyphenyl-6-methylchromen-4-one,6-methyl-4'-hydroxyflavone,2-4-hydroxyphenyl-6-methyl-4h-chromen-4-one,4h-1-benzopyran-4-one, 2-4-hydroxyphenyl-6-methyl PubChem CID: 1659442 IUPAC Name: 2-(4-hydroxyphenyl)-6-methylchromen-4-one SMILES: CC1=CC2=C(C=C1)OC(=CC2=O)C3=CC=C(C=C3)O

PubChem CID 1659442
CAS 288401-04-7
Molecular Weight (g/mol) 252.269
MDL Number MFCD03424432
SMILES CC1=CC2=C(C=C1)OC(=CC2=O)C3=CC=C(C=C3)O
Synonym 4'-hydroxy-6-methylflavone,2-4-hydroxyphenyl-6-methylchromen-4-one,6-methyl-4'-hydroxyflavone,2-4-hydroxyphenyl-6-methyl-4h-chromen-4-one,4h-1-benzopyran-4-one, 2-4-hydroxyphenyl-6-methyl
IUPAC Name 2-(4-hydroxyphenyl)-6-methylchromen-4-one
InChI Key YAACYYNCHMHECD-UHFFFAOYSA-N
Molecular Formula C16H12O3
90

2'-Amino-3'-methoxyflavone, 99%

CAS: 167869-21-8 Molecular Formula: C16H13NO3 Molecular Weight (g/mol): 267.28 MDL Number: MFCD00671789 InChI Key: QFWCYNPOPKQOKV-UHFFFAOYSA-N Synonym: 2-2-amino-3-methoxyphenyl-4h-chromen-4-one,2-2-amino-3-methoxyphenyl-4h-1-benzopyran-4-one,2-2-amino-3-methoxyphenyl chromen-4-one,2'-amino-3'-methoxyflavone,unii-sje1io5e3i,sje1io5e3i,chembl35482,2-2-amino-3-methoxyphenyl-chromen-4-one,4h-1-benzopyran-4-one, 2-2-amino-3-methoxyphenyl,2′-amino-3′-methoxyflavone PubChem CID: 4713 ChEBI: CHEBI:77954 IUPAC Name: 2-(2-amino-3-methoxyphenyl)chromen-4-one SMILES: COC1=CC=CC(=C1N)C1=CC(=O)C2=CC=CC=C2O1

PubChem CID 4713
CAS 167869-21-8
Molecular Weight (g/mol) 267.28
ChEBI CHEBI:77954
MDL Number MFCD00671789
SMILES COC1=CC=CC(=C1N)C1=CC(=O)C2=CC=CC=C2O1
Synonym 2-2-amino-3-methoxyphenyl-4h-chromen-4-one,2-2-amino-3-methoxyphenyl-4h-1-benzopyran-4-one,2-2-amino-3-methoxyphenyl chromen-4-one,2'-amino-3'-methoxyflavone,unii-sje1io5e3i,sje1io5e3i,chembl35482,2-2-amino-3-methoxyphenyl-chromen-4-one,4h-1-benzopyran-4-one, 2-2-amino-3-methoxyphenyl,2′-amino-3′-methoxyflavone
IUPAC Name 2-(2-amino-3-methoxyphenyl)chromen-4-one
InChI Key QFWCYNPOPKQOKV-UHFFFAOYSA-N
Molecular Formula C16H13NO3