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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.
Phenylpropanoic acids (435)
Cinnamic acids and derivatives (408)
Flavonoids (358)
Coumarins and derivatives (269)
Linear 1 3-diarylpropanoids (104)
Depsides and depsidones (96)
Tetracyclines (89)
Isoflavonoids (79)
Cinnamaldehydes (67)
Stilbenes (61)
Macrolide lactams (41)
Diarylheptanoids (38)
Anthracyclines (33)
Macrolactams (33)
Cinnamyl alcohols (20)
Tannins (19)
Isocoumarins and derivatives (13)
Macrolides and analogues (10)
Dihydrocoumarins (8)
Ochratoxins and related substances (7)
Angucyclines (2)

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Ricerca per parola chiave:
1 – 15 di 945 risultati
1

trans-4-Hydroxycinnamic acid, 98%

CAS: 501-98-4 Formula molecolare: C9H8O3 Molecular Weight (g/mol): 164.16 Numero MDL: MFCD00004399 InChI Key: NGSWKAQJJWESNS-ZZXKWVIFSA-N Sinonimo: 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

Sinonimo 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
Numero MDL MFCD00004399
PubChem CID 637542
Formula molecolare C9H8O3
CAS 501-98-4
Molecular Weight (g/mol) 164.16
ChEBI CHEBI:32374
SMILES C1=CC(=CC=C1C=CC(=O)O)O
IUPAC Name (E)-3-(4-hydroxyphenyl)prop-2-enoic acid
InChI Key NGSWKAQJJWESNS-ZZXKWVIFSA-N
2

Paraffin Liquid, Technical, d=0.88, for Oil Baths, Fisher Chemical™

CAS: 8042-47-5 Formula molecolare: MFCD00131611 Molecular Weight (g/mol): 0.00 Numero MDL: MFCD00131611 InChI Key: FFNDMZIBVDSQFI-UHFFFAOYSA-N Sinonimo: 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: *

EDGE
Sinonimo delphinidin chloride,delphinidin,delphinidine,delphinidol,ephdine,delfinidol chloride,unii-em6md4aehe,ccris 2518,em6md4aehe,3,5,7-trihydroxy-2-3,4,5-trihydroxyphenyl benzopyrylium chloride
Numero MDL MFCD00131611
PubChem CID 68245
Formula molecolare MFCD00131611
CAS 8042-47-5
Molecular Weight (g/mol) 0.00
ChEBI CHEBI:38701
SMILES *
IUPAC Name 2-(3,4,5-trihydroxyphenyl)chromenylium-3,5,7-triol;chloride
InChI Key FFNDMZIBVDSQFI-UHFFFAOYSA-N
3

trans-Cinnamaldehyde, 99%

CAS: 14371-10-9 Formula molecolare: C9H8O Molecular Weight (g/mol): 132.16 Numero MDL: MFCD00007000 InChI Key: KJPRLNWUNMBNBZ-QPJJXVBHSA-N Sinonimo: 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

EDGE
Sinonimo cinnamaldehyde,trans-cinnamaldehyde,cinnamic aldehyde,e-cinnamaldehyde,cinnamal,3-phenylacrylaldehyde,zimtaldehyde,cinnamylaldehyde,3-phenylpropenal,2e-3-phenylprop-2-enal
Numero MDL MFCD00007000
PubChem CID 637511
Formula molecolare C9H8O
CAS 14371-10-9
Molecular Weight (g/mol) 132.16
ChEBI CHEBI:16731
SMILES O=C\C=C\C1=CC=CC=C1
InChI Key KJPRLNWUNMBNBZ-QPJJXVBHSA-N
4

Curcumin, 95% (total curcuminoid content), from Turmeric rhizome

CAS: 458-37-7 Formula molecolare: C21H20O6 Molecular Weight (g/mol): 368.39 Numero MDL: MFCD00008365 InChI Key: ZIUSSTSXXLLKKK-KOBPDPAPSA-N Sinonimo: curcumin,diferuloylmethane,natural yellow 3,turmeric yellow,turmeric,curcuma,kacha haldi,gelbwurz,halad,curcumin i PubChem CID: 969516 ChEBI: CHEBI:3962 IUPAC Name: (1E,6E)-1,7-bis(4-hydroxy-3-methoxyphenyl)hepta-1,6-diene-3,5-dione SMILES: COC1=CC(\C=C\C(\O)=C\C(=O)\C=C\C2=CC=C(O)C(OC)=C2)=CC=C1O

EDGE
Sinonimo curcumin,diferuloylmethane,natural yellow 3,turmeric yellow,turmeric,curcuma,kacha haldi,gelbwurz,halad,curcumin i
Numero MDL MFCD00008365
PubChem CID 969516
Formula molecolare C21H20O6
CAS 458-37-7
Molecular Weight (g/mol) 368.39
ChEBI CHEBI:3962
SMILES COC1=CC(\C=C\C(\O)=C\C(=O)\C=C\C2=CC=C(O)C(OC)=C2)=CC=C1O
IUPAC Name (1E,6E)-1,7-bis(4-hydroxy-3-methoxyphenyl)hepta-1,6-diene-3,5-dione
InChI Key ZIUSSTSXXLLKKK-KOBPDPAPSA-N
5

Nujol, for IR spectroscopy

CAS: 8012-95-1 Formula molecolare: MFCD00131611 Molecular Weight (g/mol): 0.00 Numero MDL: MFCD00131611 InChI Key: FFNDMZIBVDSQFI-UHFFFAOYSA-N Sinonimo: 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: *

EDGE
Sinonimo delphinidin chloride,delphinidin,delphinidine,delphinidol,ephdine,delfinidol chloride,unii-em6md4aehe,ccris 2518,em6md4aehe,3,5,7-trihydroxy-2-3,4,5-trihydroxyphenyl benzopyrylium chloride
Numero MDL MFCD00131611
PubChem CID 68245
Formula molecolare MFCD00131611
CAS 8012-95-1
Molecular Weight (g/mol) 0.00
ChEBI CHEBI:38701
SMILES *
IUPAC Name 2-(3,4,5-trihydroxyphenyl)chromenylium-3,5,7-triol;chloride
InChI Key FFNDMZIBVDSQFI-UHFFFAOYSA-N
6

trans-Cinnamaldehyde, 98+%

CAS: 14371-10-9 Formula molecolare: C9H8O Molecular Weight (g/mol): 132.16 Numero MDL: MFCD00007000 InChI Key: KJPRLNWUNMBNBZ-QPJJXVBHSA-N Sinonimo: 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

EDGE
Sinonimo cinnamaldehyde,trans-cinnamaldehyde,cinnamic aldehyde,e-cinnamaldehyde,cinnamal,3-phenylacrylaldehyde,zimtaldehyde,cinnamylaldehyde,3-phenylpropenal,2e-3-phenylprop-2-enal
Numero MDL MFCD00007000
PubChem CID 637511
Formula molecolare C9H8O
CAS 14371-10-9
Molecular Weight (g/mol) 132.16
ChEBI CHEBI:16731
SMILES O=C\C=C\C1=CC=CC=C1
InChI Key KJPRLNWUNMBNBZ-QPJJXVBHSA-N
7

Rutin, 97+%

CAS: 207671-50-9 Formula molecolare: C27H30O16 Molecular Weight (g/mol): 610.52 Numero MDL: MFCD01319140 InChI Key: IKGXIBQEEMLURG-NVPNHPEKSA-N Sinonimo: rutin,rutoside,phytomelin,quercetin 3-rutinoside,birutan,eldrin,myrticolorin,venoruton,3-rutinosyl quercetin,bioflavonoid PubChem CID: 5280805 ChEBI: CHEBI:28527 IUPAC Name: 2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3-[(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: C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=C(OC4=CC(O)=CC(O)=C4C3=O)C3=CC(O)=C(O)C=C3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O

EDGE
Sinonimo rutin,rutoside,phytomelin,quercetin 3-rutinoside,birutan,eldrin,myrticolorin,venoruton,3-rutinosyl quercetin,bioflavonoid
Numero MDL MFCD01319140
PubChem CID 5280805
Formula molecolare C27H30O16
CAS 207671-50-9
Molecular Weight (g/mol) 610.52
ChEBI CHEBI:28527
SMILES C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=C(OC4=CC(O)=CC(O)=C4C3=O)C3=CC(O)=C(O)C=C3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O
IUPAC Name 2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3-[(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 IKGXIBQEEMLURG-NVPNHPEKSA-N
8

Coniferyl alcohol, 98%

CAS: 458-35-5 Formula molecolare: C10H12O3 Molecular Weight (g/mol): 180.20 Numero MDL: MFCD00002922 InChI Key: JMFRWRFFLBVWSI-NSCUHMNNSA-N Sinonimo: coniferyl alcohol,coniferol,coniferylalcohol,4-3-hydroxyprop-1-en-1-yl-2-methoxyphenol,gamma-hydroxyisoeugenol,trans-coniferyl alcohol,e-coniferyl alcohol,4-3-hydroxy-1-propenyl-2-methoxyphenol,3-4-hydroxy-3-methoxyphenyl-2-propen-1-ol,4-1e-3-hydroxyprop-1-en-1-yl-2-methoxyphenol PubChem CID: 1549095 ChEBI: CHEBI:17745 SMILES: COC1=CC(\C=C\CO)=CC=C1O

EDGE
Sinonimo coniferyl alcohol,coniferol,coniferylalcohol,4-3-hydroxyprop-1-en-1-yl-2-methoxyphenol,gamma-hydroxyisoeugenol,trans-coniferyl alcohol,e-coniferyl alcohol,4-3-hydroxy-1-propenyl-2-methoxyphenol,3-4-hydroxy-3-methoxyphenyl-2-propen-1-ol,4-1e-3-hydroxyprop-1-en-1-yl-2-methoxyphenol
Numero MDL MFCD00002922
PubChem CID 1549095
Formula molecolare C10H12O3
CAS 458-35-5
Molecular Weight (g/mol) 180.20
ChEBI CHEBI:17745
SMILES COC1=CC(\C=C\CO)=CC=C1O
InChI Key JMFRWRFFLBVWSI-NSCUHMNNSA-N
9

2,2-Dimethoxy-2-phenylacetophenone, 99%

CAS: 24650-42-8 Formula molecolare: C16H16O3 Molecular Weight (g/mol): 256.30 Numero MDL: MFCD00008475 InChI Key: KWVGIHKZDCUPEU-UHFFFAOYSA-N Sinonimo: 2,2-dimethoxy-2-phenylacetophenone,benzil dimethyl ketal,kayacure bdmk,irgacure 651,ethanone, 2,2-dimethoxy-1,2-diphenyl,lucirin bdk,photomer 51,benzil dimethylketal,esacure kb 1,irgacure 621 PubChem CID: 90571 IUPAC Name: 2,2-dimethoxy-1,2-diphenylethanone SMILES: COC(OC)(C(=O)C1=CC=CC=C1)C1=CC=CC=C1

EDGE
Sinonimo 2,2-dimethoxy-2-phenylacetophenone,benzil dimethyl ketal,kayacure bdmk,irgacure 651,ethanone, 2,2-dimethoxy-1,2-diphenyl,lucirin bdk,photomer 51,benzil dimethylketal,esacure kb 1,irgacure 621
Numero MDL MFCD00008475
PubChem CID 90571
Formula molecolare C16H16O3
CAS 24650-42-8
Molecular Weight (g/mol) 256.30
SMILES COC(OC)(C(=O)C1=CC=CC=C1)C1=CC=CC=C1
IUPAC Name 2,2-dimethoxy-1,2-diphenylethanone
InChI Key KWVGIHKZDCUPEU-UHFFFAOYSA-N
10

7-Hydroxycoumarin, 98%

CAS: 93-35-6 Formula molecolare: C9H6O3 Molecular Weight (g/mol): 162.14 Numero MDL: MFCD00006878 InChI Key: ORHBXUUXSCNDEV-UHFFFAOYSA-N Sinonimo: 7-hydroxycoumarin,umbelliferone,7-hydroxy-2h-chromen-2-one,hydrangin,skimmetin,7-hydroxycoumarine,7-oxycoumarin,hydrangine,skimmetine,umbelliferon PubChem CID: 5281426 ChEBI: CHEBI:27510 IUPAC Name: 7-hydroxychromen-2-one SMILES: OC1=CC=C2C=CC(=O)OC2=C1

EDGE
Sinonimo 7-hydroxycoumarin,umbelliferone,7-hydroxy-2h-chromen-2-one,hydrangin,skimmetin,7-hydroxycoumarine,7-oxycoumarin,hydrangine,skimmetine,umbelliferon
Numero MDL MFCD00006878
PubChem CID 5281426
Formula molecolare C9H6O3
CAS 93-35-6
Molecular Weight (g/mol) 162.14
ChEBI CHEBI:27510
SMILES OC1=CC=C2C=CC(=O)OC2=C1
IUPAC Name 7-hydroxychromen-2-one
InChI Key ORHBXUUXSCNDEV-UHFFFAOYSA-N
11

4-Methylumbelliferone, 97%

CAS: 90-33-5 Formula molecolare: C10H8O3 Molecular Weight (g/mol): 176.17 Numero MDL: MFCD00006866 InChI Key: HSHNITRMYYLLCV-UHFFFAOYSA-N Sinonimo: 4-methylumbelliferone,hymecromone,7-hydroxy-4-methylcoumarin,imecromone,7-hydroxy-4-methyl-2h-chromen-2-one,cholestil,mendiaxon,4-methyl-7-hydroxycoumarin,beta-methylumbelliferone,bilcolic PubChem CID: 5280567 ChEBI: CHEBI:17224 IUPAC Name: 7-hydroxy-4-methylchromen-2-one SMILES: CC1=CC(=O)OC2=CC(O)=CC=C12

EDGE
Sinonimo 4-methylumbelliferone,hymecromone,7-hydroxy-4-methylcoumarin,imecromone,7-hydroxy-4-methyl-2h-chromen-2-one,cholestil,mendiaxon,4-methyl-7-hydroxycoumarin,beta-methylumbelliferone,bilcolic
Numero MDL MFCD00006866
PubChem CID 5280567
Formula molecolare C10H8O3
CAS 90-33-5
Molecular Weight (g/mol) 176.17
ChEBI CHEBI:17224
SMILES CC1=CC(=O)OC2=CC(O)=CC=C12
IUPAC Name 7-hydroxy-4-methylchromen-2-one
InChI Key HSHNITRMYYLLCV-UHFFFAOYSA-N
12

4-Hydroxy-3-methoxycinnamic acid, 99%

CAS: 1135-24-6 Formula molecolare: C10H10O4 Molecular Weight (g/mol): 194.19 Numero MDL: MFCD00004400 InChI Key: KSEBMYQBYZTDHS-HWKANZROSA-N Sinonimo: ferulic acid,trans-ferulic acid,4-hydroxy-3-methoxycinnamic acid,trans-4-hydroxy-3-methoxycinnamic acid,3-4-hydroxy-3-methoxyphenyl acrylic acid,e-ferulic acid,coniferic acid,ferulate,ferulic acid, trans,2-propenoic acid, 3-4-hydroxy-3-methoxyphenyl PubChem CID: 445858 ChEBI: CHEBI:17620 IUPAC Name: (E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoic acid SMILES: COC1=C(C=CC(=C1)C=CC(=O)O)O

EDGE
Sinonimo ferulic acid,trans-ferulic acid,4-hydroxy-3-methoxycinnamic acid,trans-4-hydroxy-3-methoxycinnamic acid,3-4-hydroxy-3-methoxyphenyl acrylic acid,e-ferulic acid,coniferic acid,ferulate,ferulic acid, trans,2-propenoic acid, 3-4-hydroxy-3-methoxyphenyl
Numero MDL MFCD00004400
PubChem CID 445858
Formula molecolare C10H10O4
CAS 1135-24-6
Molecular Weight (g/mol) 194.19
ChEBI CHEBI:17620
SMILES COC1=C(C=CC(=C1)C=CC(=O)O)O
IUPAC Name (E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoic acid
InChI Key KSEBMYQBYZTDHS-HWKANZROSA-N
13

Thermo Scientific Chemicals Curcumin (mixture of curcumin, demethoxycurcumin, and bisdemethoxycurcumin), 96%

CAS: 458-37-7 Formula molecolare: C21H20O6 Molecular Weight (g/mol): 368.39 Numero MDL: MFCD00008365 InChI Key: ZIUSSTSXXLLKKK-KOBPDPAPSA-N Sinonimo: curcumin,diferuloylmethane,natural yellow 3,turmeric yellow,turmeric,curcuma,kacha haldi,gelbwurz,halad,curcumin i PubChem CID: 969516 ChEBI: CHEBI:3962 SMILES: COC1=CC(\C=C\C(\O)=C\C(=O)\C=C\C2=CC=C(O)C(OC)=C2)=CC=C1O

EDGE
Sinonimo curcumin,diferuloylmethane,natural yellow 3,turmeric yellow,turmeric,curcuma,kacha haldi,gelbwurz,halad,curcumin i
Numero MDL MFCD00008365
PubChem CID 969516
Formula molecolare C21H20O6
CAS 458-37-7
Molecular Weight (g/mol) 368.39
ChEBI CHEBI:3962
SMILES COC1=CC(\C=C\C(\O)=C\C(=O)\C=C\C2=CC=C(O)C(OC)=C2)=CC=C1O
InChI Key ZIUSSTSXXLLKKK-KOBPDPAPSA-N
14

7-Diethylamino-4-methylcoumarin, 99%

CAS: 91-44-1 Formula molecolare: C14H17NO2 Molecular Weight (g/mol): 231.295 Numero MDL: MFCD00006864 InChI Key: AFYCEAFSNDLKSX-UHFFFAOYSA-N Sinonimo: 7-diethylamino-4-methylcoumarin,coumarin 1,7-diethylamino-4-methyl-2h-chromen-2-one,coumarin 47,coumarin 460,4-methyl-7-diethylamino coumarin,blancophor aw,blancophor ffg,4-methyl-7-diethylaminocoumarin,hakkol p PubChem CID: 7050 ChEBI: CHEBI:51938 IUPAC Name: 7-(diethylamino)-4-methylchromen-2-one SMILES: CCN(CC)C1=CC2=C(C=C1)C(=CC(=O)O2)C

EDGE
Sinonimo 7-diethylamino-4-methylcoumarin,coumarin 1,7-diethylamino-4-methyl-2h-chromen-2-one,coumarin 47,coumarin 460,4-methyl-7-diethylamino coumarin,blancophor aw,blancophor ffg,4-methyl-7-diethylaminocoumarin,hakkol p
Numero MDL MFCD00006864
PubChem CID 7050
Formula molecolare C14H17NO2
CAS 91-44-1
Molecular Weight (g/mol) 231.295
ChEBI CHEBI:51938
SMILES CCN(CC)C1=CC2=C(C=C1)C(=CC(=O)O2)C
IUPAC Name 7-(diethylamino)-4-methylchromen-2-one
InChI Key AFYCEAFSNDLKSX-UHFFFAOYSA-N
15

Phenyl benzoate, 99%

CAS: 93-99-2 Formula molecolare: C13H10O2 Molecular Weight (g/mol): 198.22 Numero MDL: MFCD00003072 InChI Key: FCJSHPDYVMKCHI-UHFFFAOYSA-N Sinonimo: benzoic acid phenyl ester,diphenylcarboxylate,benzoic acid, phenyl ester,benzoic acid phenyl,phenylbenzoate,unii-b8a3wvz590,phenol, benzoate,dsstox_cid_28185,dsstox_rid_82744,dsstox_gsid_48210 PubChem CID: 7169 ChEBI: CHEBI:86919 IUPAC Name: phenyl benzoate SMILES: C1=CC=C(C=C1)C(=O)OC2=CC=CC=C2

EDGE
Sinonimo benzoic acid phenyl ester,diphenylcarboxylate,benzoic acid, phenyl ester,benzoic acid phenyl,phenylbenzoate,unii-b8a3wvz590,phenol, benzoate,dsstox_cid_28185,dsstox_rid_82744,dsstox_gsid_48210
Numero MDL MFCD00003072
PubChem CID 7169
Formula molecolare C13H10O2
CAS 93-99-2
Molecular Weight (g/mol) 198.22
ChEBI CHEBI:86919
SMILES C1=CC=C(C=C1)C(=O)OC2=CC=CC=C2
IUPAC Name phenyl benzoate
InChI Key FCJSHPDYVMKCHI-UHFFFAOYSA-N