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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 (863)
Cinnamic acids and derivatives (839)
Coumarins and derivatives (669)
Linear 1 3-diarylpropanoids (417)
Phenylpropanoic acids (332)
Depsides and depsidones (285)
Isoflavonoids (201)
Cinnamaldehydes (120)
Stilbenes (105)
Macrolide lactams (80)
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Macrolactams (22)
Dihydrocoumarins (17)
Neoflavonoids (14)
Ochratoxins and related substances (11)
Angucyclines (1)

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61 – 75 of 3,527 results
61

4-(5-bromothien-2-yl)pyridine, 97%, Thermo Scientific™

CAS: 2199-93-1 Molecular Formula: C11H7BrO3 Molecular Weight (g/mol): 267.08 MDL Number: MFCD00024075 InChI Key: XFQYOFLFNKCHLG-UHFFFAOYSA-N Synonym: 3-acetyl-6-bromocoumarin,3-acetyl-6-bromo-2h-chromen-2-one,3-acetyl-6-bromo-chromen-2-one,2h-1-benzopyran-2-one,3-acetyl-6-bromo,3-acetyl-6-bromo-2-oxochromene,pubchem13336,maybridge1_000212,zerenex e/1034014,6-bromanyl-3-ethanoyl-chromen-2-one PubChem CID: 304813 IUPAC Name: 3-acetyl-6-bromochromen-2-one SMILES: CC(=O)C1=CC2=CC(Br)=CC=C2OC1=O

PubChem CID 304813
CAS 2199-93-1
Molecular Weight (g/mol) 267.08
MDL Number MFCD00024075
SMILES CC(=O)C1=CC2=CC(Br)=CC=C2OC1=O
Synonym 3-acetyl-6-bromocoumarin,3-acetyl-6-bromo-2h-chromen-2-one,3-acetyl-6-bromo-chromen-2-one,2h-1-benzopyran-2-one,3-acetyl-6-bromo,3-acetyl-6-bromo-2-oxochromene,pubchem13336,maybridge1_000212,zerenex e/1034014,6-bromanyl-3-ethanoyl-chromen-2-one
IUPAC Name 3-acetyl-6-bromochromen-2-one
InChI Key XFQYOFLFNKCHLG-UHFFFAOYSA-N
Molecular Formula C11H7BrO3
62

3,4-Dichloroisocoumarin, 98%

CAS: 51050-59-0 Molecular Formula: C9H4Cl2O2 Molecular Weight (g/mol): 215.03 MDL Number: MFCD00036960 InChI Key: SUGXUUGGLDCZKB-UHFFFAOYSA-N Synonym: 3,4-dichloroisocoumarin,3,4-dcl,1h-2-benzopyran-1-one,3,4-dichloro,3,4-dci,3,4 dichloroisocoumarin,3,4-dichloro-1h-isochromen-1-one,3,4-dichloro-1h-2-benzopyran-1-one,1h-2-benzopyran-1-one, 3,4-dichloro,chembl24983,3,4-dichloro-2-benzopyran-1-one PubChem CID: 1609 IUPAC Name: 3,4-dichloroisochromen-1-one SMILES: ClC1=C(Cl)C2=CC=CC=C2C(=O)O1

PubChem CID 1609
CAS 51050-59-0
Molecular Weight (g/mol) 215.03
MDL Number MFCD00036960
SMILES ClC1=C(Cl)C2=CC=CC=C2C(=O)O1
Synonym 3,4-dichloroisocoumarin,3,4-dcl,1h-2-benzopyran-1-one,3,4-dichloro,3,4-dci,3,4 dichloroisocoumarin,3,4-dichloro-1h-isochromen-1-one,3,4-dichloro-1h-2-benzopyran-1-one,1h-2-benzopyran-1-one, 3,4-dichloro,chembl24983,3,4-dichloro-2-benzopyran-1-one
IUPAC Name 3,4-dichloroisochromen-1-one
InChI Key SUGXUUGGLDCZKB-UHFFFAOYSA-N
Molecular Formula C9H4Cl2O2
63

Minocycline Hydrochloride, MP Biomedicals™

CAS: 13614-98-7 Molecular Formula: C23H28ClN3O7 Molecular Weight (g/mol): 493.94 MDL Number: MFCD00083669 InChI Key: KDLQIOPKJDNQIM-WUURTAMISA-N Synonym: minocycline hydrochloride,minocycline hcl,minomycin,minocin,minocycline chloride,arestin,vectrin,minomax,periocline,tri-mino PubChem CID: 54685925 IUPAC Name: hydrogen (2Z,4S,4aS,5aR,12aS)-2-[amino(hydroxy)methylidene]-4,7-bis(dimethylamino)-10,11,12a-trihydroxy-1,2,3,4,4a,5,5a,6,12,12a-decahydrotetracene-1,3,12-trione chloride SMILES: [H+].[Cl-].CN(C)[C@H]1[C@@H]2C[C@@H]3CC4=C(C=CC(O)=C4C(O)=C3C(=O)[C@]2(O)C(=O)\C(=C(\N)O)C1=O)N(C)C

PubChem CID 54685925
CAS 13614-98-7
Molecular Weight (g/mol) 493.94
MDL Number MFCD00083669
SMILES [H+].[Cl-].CN(C)[C@H]1[C@@H]2C[C@@H]3CC4=C(C=CC(O)=C4C(O)=C3C(=O)[C@]2(O)C(=O)\C(=C(\N)O)C1=O)N(C)C
Synonym minocycline hydrochloride,minocycline hcl,minomycin,minocin,minocycline chloride,arestin,vectrin,minomax,periocline,tri-mino
IUPAC Name hydrogen (2Z,4S,4aS,5aR,12aS)-2-[amino(hydroxy)methylidene]-4,7-bis(dimethylamino)-10,11,12a-trihydroxy-1,2,3,4,4a,5,5a,6,12,12a-decahydrotetracene-1,3,12-trione chloride
InChI Key KDLQIOPKJDNQIM-WUURTAMISA-N
Molecular Formula C23H28ClN3O7
64

Esculin, Spectrum™ Chemical
SDP

CAS: 531-75-9

CAS 531-75-9
65

1,3-Diphenyl-2-propyn-1-ol, tech. 90%

CAS: 1817-49-8 Molecular Formula: C15H12O Molecular Weight (g/mol): 208.26 MDL Number: MFCD06654198 InChI Key: DZZWMODRWHHWFR-UHFFFAOYSA-N Synonym: 1,3-diphenyl-2-propyn-1-ol,1,3-diphenyl-prop-2-yn-1-ol,1-phenyl-3-phenyl-propyn-3-ol,1,3-diphenylpropargyl alcohol,benzenemethanol, a-2-phenylethynyl,alpha-phenyl ethynyl-benzenemethanol PubChem CID: 296659 IUPAC Name: 1,3-diphenylprop-2-yn-1-ol SMILES: C1=CC=C(C=C1)C#CC(C2=CC=CC=C2)O

PubChem CID 296659
CAS 1817-49-8
Molecular Weight (g/mol) 208.26
MDL Number MFCD06654198
SMILES C1=CC=C(C=C1)C#CC(C2=CC=CC=C2)O
Synonym 1,3-diphenyl-2-propyn-1-ol,1,3-diphenyl-prop-2-yn-1-ol,1-phenyl-3-phenyl-propyn-3-ol,1,3-diphenylpropargyl alcohol,benzenemethanol, a-2-phenylethynyl,alpha-phenyl ethynyl-benzenemethanol
IUPAC Name 1,3-diphenylprop-2-yn-1-ol
InChI Key DZZWMODRWHHWFR-UHFFFAOYSA-N
Molecular Formula C15H12O
66

trans-Cinnamaldehyde, 98%, Spectrum™ Chemical
SDP

CAS: 14371-10-9

CAS 14371-10-9
68

3-Phenylpropiophenone, 98%

CAS: 1083-30-3 Molecular Formula: C15H14O Molecular Weight (g/mol): 210.276 MDL Number: MFCD00039563 InChI Key: QGGZBXOADPVUPN-UHFFFAOYSA-N Synonym: dihydrochalcone,3-phenylpropiophenone,benzylacetophenone,hydrochalcone,1,3-diphenyl-1-propanone,beta-phenylpropiophenone,hydrocinnamophenone,1,3-diphenyl-1-oxopropane,phenethyl phenyl ketone,phenyl phenethyl ketone PubChem CID: 64802 ChEBI: CHEBI:71231 IUPAC Name: 1,3-diphenylpropan-1-one SMILES: C1=CC=C(C=C1)CCC(=O)C2=CC=CC=C2

PubChem CID 64802
CAS 1083-30-3
Molecular Weight (g/mol) 210.276
ChEBI CHEBI:71231
MDL Number MFCD00039563
SMILES C1=CC=C(C=C1)CCC(=O)C2=CC=CC=C2
Synonym dihydrochalcone,3-phenylpropiophenone,benzylacetophenone,hydrochalcone,1,3-diphenyl-1-propanone,beta-phenylpropiophenone,hydrocinnamophenone,1,3-diphenyl-1-oxopropane,phenethyl phenyl ketone,phenyl phenethyl ketone
IUPAC Name 1,3-diphenylpropan-1-one
InChI Key QGGZBXOADPVUPN-UHFFFAOYSA-N
Molecular Formula C15H14O
69

4',5,7-Trihydroxyflavanone, 97%

CAS: 480-41-1 Molecular Formula: C15H12O5 Molecular Weight (g/mol): 272.26 MDL Number: MFCD00006844 InChI Key: FTVWIRXFELQLPI-CYBMUJFWSA-N Synonym: 2r-naringenin,r-naringenin,naringenin,2r-5,7-dihydroxy-2-4-hydroxyphenyl-2,3-dihydro-4h-chromen-4-one,--naringenin,+-2r-5,7-dihydroxy-2-4-hydroxyphenyl chroman-4-one,2,3-dihydro-5,7-dihydroxy-2-4-hydroxyphenyl-4-benzopyrone,+-naringenin,2r-5,7,4'-trihydroxyflavone,2r-4',5,7-trihydroxyflavanone PubChem CID: 667495 ChEBI: CHEBI:50201 IUPAC Name: (2R)-5,7-dihydroxy-2-(4-hydroxyphenyl)-2,3-dihydrochromen-4-one SMILES: C1C(OC2=CC(=CC(=C2C1=O)O)O)C3=CC=C(C=C3)O

PubChem CID 667495
CAS 480-41-1
Molecular Weight (g/mol) 272.26
ChEBI CHEBI:50201
MDL Number MFCD00006844
SMILES C1C(OC2=CC(=CC(=C2C1=O)O)O)C3=CC=C(C=C3)O
Synonym 2r-naringenin,r-naringenin,naringenin,2r-5,7-dihydroxy-2-4-hydroxyphenyl-2,3-dihydro-4h-chromen-4-one,--naringenin,+-2r-5,7-dihydroxy-2-4-hydroxyphenyl chroman-4-one,2,3-dihydro-5,7-dihydroxy-2-4-hydroxyphenyl-4-benzopyrone,+-naringenin,2r-5,7,4'-trihydroxyflavone,2r-4',5,7-trihydroxyflavanone
IUPAC Name (2R)-5,7-dihydroxy-2-(4-hydroxyphenyl)-2,3-dihydrochromen-4-one
InChI Key FTVWIRXFELQLPI-CYBMUJFWSA-N
Molecular Formula C15H12O5
70

4-Ethoxycinnamic acid, prediminantly trans, 98+%

CAS: 2373-79-7 Molecular Formula: C11H12O3 Molecular Weight (g/mol): 192.214 MDL Number: MFCD00016848 InChI Key: DZLOUWYGNATKKZ-VMPITWQZSA-N Synonym: 4-ethoxycinnamic acid,3-4-ethoxyphenyl acrylic acid,2e-3-4-ethoxyphenyl acrylic acid,2e-3-4-ethoxyphenyl prop-2-enoic acid,e-3-4-ethoxyphenyl acrylic acid,e-3-4-ethoxyphenyl prop-2-enoic acid,4-ethoxyphenylacrylic acid,p-ethoxycinnamic acid,ethoxyphenylacrylicacid,pubchem8239 PubChem CID: 704218 IUPAC Name: (E)-3-(4-ethoxyphenyl)prop-2-enoic acid SMILES: CCOC1=CC=C(C=C1)C=CC(=O)O

PubChem CID 704218
CAS 2373-79-7
Molecular Weight (g/mol) 192.214
MDL Number MFCD00016848
SMILES CCOC1=CC=C(C=C1)C=CC(=O)O
Synonym 4-ethoxycinnamic acid,3-4-ethoxyphenyl acrylic acid,2e-3-4-ethoxyphenyl acrylic acid,2e-3-4-ethoxyphenyl prop-2-enoic acid,e-3-4-ethoxyphenyl acrylic acid,e-3-4-ethoxyphenyl prop-2-enoic acid,4-ethoxyphenylacrylic acid,p-ethoxycinnamic acid,ethoxyphenylacrylicacid,pubchem8239
IUPAC Name (E)-3-(4-ethoxyphenyl)prop-2-enoic acid
InChI Key DZLOUWYGNATKKZ-VMPITWQZSA-N
Molecular Formula C11H12O3
71

Quercetin dihydrate, 99.85%, For HPLC analysis, MP Biomedicals™

CAS: 6151-25-3 Molecular Formula: C15H14O9 Molecular Weight (g/mol): 338.27 MDL Number: MFCD00149487 InChI Key: GMGIWEZSKCNYSW-UHFFFAOYSA-N Synonym: quercetin dihydrate,2-3,4-dihydroxyphenyl-3,5,7-trihydroxy-4h-chromen-4-one dihydrate,quercetine dihydrate,quercetin, dihydrate,ccris 3304,3,3',4',5,7-pentahydroxyflavone dihydrate,quercetin dihydrate sophoretin,flavone, 3,3',4',5,7-pentahydroxy-, dihydrate,dsstox_cid_1219,2-3,4-dihydroxyphenyl-3,5,7-trihydroxy-4h-1-benzopyran-4-one dihydrate PubChem CID: 5284452 IUPAC Name: 2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-4H-chromen-4-one dihydrate SMILES: O.O.OC1=CC(O)=C2C(OC(=C(O)C2=O)C2=CC=C(O)C(O)=C2)=C1

PubChem CID 5284452
CAS 6151-25-3
Molecular Weight (g/mol) 338.27
MDL Number MFCD00149487
SMILES O.O.OC1=CC(O)=C2C(OC(=C(O)C2=O)C2=CC=C(O)C(O)=C2)=C1
Synonym quercetin dihydrate,2-3,4-dihydroxyphenyl-3,5,7-trihydroxy-4h-chromen-4-one dihydrate,quercetine dihydrate,quercetin, dihydrate,ccris 3304,3,3',4',5,7-pentahydroxyflavone dihydrate,quercetin dihydrate sophoretin,flavone, 3,3',4',5,7-pentahydroxy-, dihydrate,dsstox_cid_1219,2-3,4-dihydroxyphenyl-3,5,7-trihydroxy-4h-1-benzopyran-4-one dihydrate
IUPAC Name 2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-4H-chromen-4-one dihydrate
InChI Key GMGIWEZSKCNYSW-UHFFFAOYSA-N
Molecular Formula C15H14O9
72

Thermo Scientific Chemicals 4-Epioxytetracycline, 'can be used as secondary standard'

CAS: 14206-58-7 Molecular Formula: C22H24N2O9 Molecular Weight (g/mol): 460.43 MDL Number: MFCD00062825 InChI Key: OWFJMIVZYSDULZ-DVJPNYBFSA-N Synonym: 4-epioxytetracyline,unii-73von8sry5,4-epioxytetracycline,73von8sry5,4r,4ar,5s,5ar,6s,12as-4-dimethylamino-3,5,6,10,12,12a-hexahydroxy-6-methyl-1,11-dioxo-4,4a,5,5a-tetrahydrotetracene-2-carboxamide,hydroxy quatrimycin,oxytetracycline dihydrate specified impurity a ep,oxytetracycline hydrochloride specified impurity a ep,4r,4ar,5s,5ar,6s,12as-4-dimethylamino-3,5,6,10,12,12a-hexahydroxy-6-methyl-1,11-dioxo-1,4,4a,5,5a,6,11,12a-octahydrotetracene-2-carboxamide,2-naphthacenecarboxamide, 4-dimethylamino-1,4,4a,5,5a,6,11,12a-octahydro-3,5,6,10,12,12a-hexahydroxy-6-methyl-1,11-dioxo-, 4r,4ar,5s,5ar,6s,12as PubChem CID: 54678403 IUPAC Name: (4R,4aR,5S,5aR,6S,12aR)-4-(dimethylamino)-1,5,6,10,11,12a-hexahydroxy-6-methyl-3,12-dioxo-4,4a,5,5a-tetrahydrotetracene-2-carboxamide SMILES: CC1(C2C(C3C(C(=O)C(=C(C3(C(=O)C2=C(C4=C1C=CC=C4O)O)O)O)C(=O)N)N(C)C)O)O

PubChem CID 54678403
CAS 14206-58-7
Molecular Weight (g/mol) 460.43
MDL Number MFCD00062825
SMILES CC1(C2C(C3C(C(=O)C(=C(C3(C(=O)C2=C(C4=C1C=CC=C4O)O)O)O)C(=O)N)N(C)C)O)O
Synonym 4-epioxytetracyline,unii-73von8sry5,4-epioxytetracycline,73von8sry5,4r,4ar,5s,5ar,6s,12as-4-dimethylamino-3,5,6,10,12,12a-hexahydroxy-6-methyl-1,11-dioxo-4,4a,5,5a-tetrahydrotetracene-2-carboxamide,hydroxy quatrimycin,oxytetracycline dihydrate specified impurity a ep,oxytetracycline hydrochloride specified impurity a ep,4r,4ar,5s,5ar,6s,12as-4-dimethylamino-3,5,6,10,12,12a-hexahydroxy-6-methyl-1,11-dioxo-1,4,4a,5,5a,6,11,12a-octahydrotetracene-2-carboxamide,2-naphthacenecarboxamide, 4-dimethylamino-1,4,4a,5,5a,6,11,12a-octahydro-3,5,6,10,12,12a-hexahydroxy-6-methyl-1,11-dioxo-, 4r,4ar,5s,5ar,6s,12as
IUPAC Name (4R,4aR,5S,5aR,6S,12aR)-4-(dimethylamino)-1,5,6,10,11,12a-hexahydroxy-6-methyl-3,12-dioxo-4,4a,5,5a-tetrahydrotetracene-2-carboxamide
InChI Key OWFJMIVZYSDULZ-DVJPNYBFSA-N
Molecular Formula C22H24N2O9
73

(+/-)-2-Phenylpropionic acid, 98%

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
74

Paraffin Oil Heavy, MilliporeSigma™

CAS: 8012-95-1 Molecular Formula: MFCD00131611 Molecular Weight (g/mol): 0.00 MDL Number: MFCD00131611 InChI Key: FFNDMZIBVDSQFI-UHFFFAOYSA-N Synonym: delphinidin chloride,delphinidin,delphinidine,delphinidol,ephdine,delfinidol chloride,unii-em6md4aehe,ccris 2518,em6md4aehe,3,5,7-trihydroxy-2-3,4,5-trihydroxyphenyl benzopyrylium chloride PubChem CID: 68245 ChEBI: CHEBI:38701 IUPAC Name: 2-(3,4,5-trihydroxyphenyl)chromenylium-3,5,7-triol;chloride SMILES: *

PubChem CID 68245
CAS 8012-95-1
Molecular Weight (g/mol) 0.00
ChEBI CHEBI:38701
MDL Number MFCD00131611
SMILES *
Synonym delphinidin chloride,delphinidin,delphinidine,delphinidol,ephdine,delfinidol chloride,unii-em6md4aehe,ccris 2518,em6md4aehe,3,5,7-trihydroxy-2-3,4,5-trihydroxyphenyl benzopyrylium chloride
IUPAC Name 2-(3,4,5-trihydroxyphenyl)chromenylium-3,5,7-triol;chloride
InChI Key FFNDMZIBVDSQFI-UHFFFAOYSA-N
Molecular Formula MFCD00131611
75

trans-Cinnamaldehyde, 99%

CAS: 14371-10-9 Molecular Formula: C9H8O Molecular Weight (g/mol): 132.16 MDL Number: MFCD00007000 InChI Key: KJPRLNWUNMBNBZ-QPJJXVBHSA-N Synonym: cinnamaldehyde,trans-cinnamaldehyde,cinnamic aldehyde,e-cinnamaldehyde,cinnamal,3-phenylacrylaldehyde,zimtaldehyde,cinnamylaldehyde,3-phenylpropenal,2e-3-phenylprop-2-enal PubChem CID: 637511 ChEBI: CHEBI:16731 SMILES: O=C\C=C\C1=CC=CC=C1

PubChem CID 637511
CAS 14371-10-9
Molecular Weight (g/mol) 132.16
ChEBI CHEBI:16731
MDL Number MFCD00007000
SMILES O=C\C=C\C1=CC=CC=C1
Synonym cinnamaldehyde,trans-cinnamaldehyde,cinnamic aldehyde,e-cinnamaldehyde,cinnamal,3-phenylacrylaldehyde,zimtaldehyde,cinnamylaldehyde,3-phenylpropenal,2e-3-phenylprop-2-enal
InChI Key KJPRLNWUNMBNBZ-QPJJXVBHSA-N
Molecular Formula C9H8O