Phenylpropanoider og polyketider
Filtrerede søgeresultater
trans-4-hydroxycinnaminsyre, 98 %
CAS: 501-98-4 Molekylær formel: C9H8O3 Molekylvægt (g/mol): 164.16 MDL nummer: MFCD00004399 InChI nøgle: 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 navn: (E)-3-(4-hydroxyphenyl)prop-2-ensyre SMIL: C1=CC(=CC=C1C=CC(=O)O)O
| MDL nummer | MFCD00004399 |
|---|---|
| PubChem CID | 637542 |
| Molekylvægt (g/mol) | 164.16 |
| CAS | 501-98-4 |
| ChEBI | CHEBI:32374 |
| 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 |
| SMIL | C1=CC(=CC=C1C=CC(=O)O)O |
| IUPAC navn | (E)-3-(4-hydroxyphenyl)prop-2-ensyre |
| InChI nøgle | NGSWKAQJJWESNS-ZZXKWVIFSA-N |
| Molekylær formel | C9H8O3 |
trans-Cinnamaldehyd, 99%
CAS: 14371-10-9 Molekylær formel: C9H8O Molekylvægt (g/mol): 132.16 MDL nummer: MFCD00007000 InChI nøgle: 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 SMIL: O=C\C=C\C1=CC=CC=C1
| MDL nummer | MFCD00007000 |
|---|---|
| PubChem CID | 637511 |
| Molekylvægt (g/mol) | 132.16 |
| CAS | 14371-10-9 |
| ChEBI | CHEBI:16731 |
| Synonym | cinnamaldehyde,trans-cinnamaldehyde,cinnamic aldehyde,e-cinnamaldehyde,cinnamal,3-phenylacrylaldehyde,zimtaldehyde,cinnamylaldehyde,3-phenylpropenal,2e-3-phenylprop-2-enal |
| SMIL | O=C\C=C\C1=CC=CC=C1 |
| InChI nøgle | KJPRLNWUNMBNBZ-QPJJXVBHSA-N |
| Molekylær formel | C9H8O |
Curcumin, 95% (samlet indhold af curcuminoid), fra gurkemeje rhizom
CAS: 458-37-7 Molekylær formel: C21H20O6 Molekylvægt (g/mol): 368.39 MDL nummer: MFCD00008365 InChI nøgle: ZIUSSTSXXLLKKK-KOBPDPAPSA-N Synonym: curcumin,diferuloylmethane,natural yellow 3,turmeric yellow,turmeric,curcuma,kacha haldi,gelbwurz,halad,curcumin i PubChem CID: 969516 ChEBI: CHEBI:3962 IUPAC navn: (1E,6E)-1,7-bis(4-hydroxy-3-methoxyphenyl)hepta-1,6-dien-3,5-dion SMIL: COC1=CC(\C=C\C(\O)=C\C(=O)\C=C\C2=CC=C(O)C(OC)=C2)=CC=C1O
| MDL nummer | MFCD00008365 |
|---|---|
| PubChem CID | 969516 |
| Molekylvægt (g/mol) | 368.39 |
| CAS | 458-37-7 |
| ChEBI | CHEBI:3962 |
| Synonym | curcumin,diferuloylmethane,natural yellow 3,turmeric yellow,turmeric,curcuma,kacha haldi,gelbwurz,halad,curcumin i |
| SMIL | COC1=CC(\C=C\C(\O)=C\C(=O)\C=C\C2=CC=C(O)C(OC)=C2)=CC=C1O |
| IUPAC navn | (1E,6E)-1,7-bis(4-hydroxy-3-methoxyphenyl)hepta-1,6-dien-3,5-dion |
| InChI nøgle | ZIUSSTSXXLLKKK-KOBPDPAPSA-N |
| Molekylær formel | C21H20O6 |
Nujol, til IR-spektroskopi
CAS: 8012-95-1 Molekylær formel: MFCD00131611 Molekylvægt (g/mol): 0.00 MDL nummer: MFCD00131611 InChI nøgle: 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 navn: 2-(3,4,5-trihydroxyphenyl)chromenylium-3,5,7-triol;chlorid SMIL: *
| MDL nummer | MFCD00131611 |
|---|---|
| PubChem CID | 68245 |
| Molekylvægt (g/mol) | 0.00 |
| CAS | 8012-95-1 |
| ChEBI | CHEBI:38701 |
| 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 |
| SMIL | * |
| IUPAC navn | 2-(3,4,5-trihydroxyphenyl)chromenylium-3,5,7-triol;chlorid |
| InChI nøgle | FFNDMZIBVDSQFI-UHFFFAOYSA-N |
| Molekylær formel | MFCD00131611 |
Rutin, 97+%
CAS: 207671-50-9 Molekylær formel: C27H30O16 Molekylvægt (g/mol): 610.52 MDL nummer: MFCD01319140 InChI nøgle: IKGXIBQEEMLURG-NVPNHPEKSA-N Synonym: rutin,rutoside,phytomelin,quercetin 3-rutinoside,birutan,eldrin,myrticolorin,venoruton,3-rutinosyl quercetin,bioflavonoid PubChem CID: 5280805 ChEBI: CHEBI:28527 IUPAC navn: 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]noxymethyl]-oxychromen SMIL: 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
| MDL nummer | MFCD01319140 |
|---|---|
| PubChem CID | 5280805 |
| Molekylvægt (g/mol) | 610.52 |
| CAS | 207671-50-9 |
| ChEBI | CHEBI:28527 |
| Synonym | rutin,rutoside,phytomelin,quercetin 3-rutinoside,birutan,eldrin,myrticolorin,venoruton,3-rutinosyl quercetin,bioflavonoid |
| SMIL | 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 navn | 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]noxymethyl]-oxychromen |
| InChI nøgle | IKGXIBQEEMLURG-NVPNHPEKSA-N |
| Molekylær formel | C27H30O16 |
(+)-Rutin trihydrat, 95%
CAS: 250249-75-3 Molekylær formel: C27H36O19 Molekylvægt (g/mol): 664.566 MDL nummer: MFCD00149490 InChI nøgle: NLLBWFFSGHKUSY-JPRRWYCFSA-N Synonym: rutoside trihydrate,+-rutin trihydrate,rutin trihydrate,rutin hydrate,unii-rf4n03853g,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-methyltetrahydro-2h-pyran-2-yl oxy methyl tetrahydro-2h-pyran-2-yl oxy-4h-chromen-4-one trihydrate,rutoside trihydrate ep,rutin hydrate jan,rutin trihydrate hplc,rutin trihydrate, analytical standard PubChem CID: 16218542 IUPAC navn: 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]-2-oxymethyl]-oxan-hydrat; SMIL: CC1C(C(C(C(O1)OCC2C(C(C(C(O2)OC3=C(OC4=CC(=CC(=C4C3=O)O)O)C5=CC(=C(C=C5)O)O)O)O)O)O)O)O.O.O.O
| MDL nummer | MFCD00149490 |
|---|---|
| PubChem CID | 16218542 |
| Molekylvægt (g/mol) | 664.566 |
| CAS | 250249-75-3 |
| Synonym | rutoside trihydrate,+-rutin trihydrate,rutin trihydrate,rutin hydrate,unii-rf4n03853g,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-methyltetrahydro-2h-pyran-2-yl oxy methyl tetrahydro-2h-pyran-2-yl oxy-4h-chromen-4-one trihydrate,rutoside trihydrate ep,rutin hydrate jan,rutin trihydrate hplc,rutin trihydrate, analytical standard |
| SMIL | CC1C(C(C(C(O1)OCC2C(C(C(C(O2)OC3=C(OC4=CC(=CC(=C4C3=O)O)O)C5=CC(=C(C=C5)O)O)O)O)O)O)O)O.O.O.O |
| IUPAC navn | 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]-2-oxymethyl]-oxan-hydrat; |
| InChI nøgle | NLLBWFFSGHKUSY-JPRRWYCFSA-N |
| Molekylær formel | C27H36O19 |
Thermo Scientific Chemicals Curcumin (blanding af curcumin, demethoxycurcumin og bisdemethoxycurcumin), 96 %
CAS: 458-37-7 Molekylær formel: C21H20O6 Molekylvægt (g/mol): 368.39 MDL nummer: MFCD00008365 InChI nøgle: ZIUSSTSXXLLKKK-KOBPDPAPSA-N Synonym: curcumin,diferuloylmethane,natural yellow 3,turmeric yellow,turmeric,curcuma,kacha haldi,gelbwurz,halad,curcumin i PubChem CID: 969516 ChEBI: CHEBI:3962 SMIL: COC1=CC(\C=C\C(\O)=C\C(=O)\C=C\C2=CC=C(O)C(OC)=C2)=CC=C1O
| MDL nummer | MFCD00008365 |
|---|---|
| PubChem CID | 969516 |
| Molekylvægt (g/mol) | 368.39 |
| CAS | 458-37-7 |
| ChEBI | CHEBI:3962 |
| Synonym | curcumin,diferuloylmethane,natural yellow 3,turmeric yellow,turmeric,curcuma,kacha haldi,gelbwurz,halad,curcumin i |
| SMIL | COC1=CC(\C=C\C(\O)=C\C(=O)\C=C\C2=CC=C(O)C(OC)=C2)=CC=C1O |
| InChI nøgle | ZIUSSTSXXLLKKK-KOBPDPAPSA-N |
| Molekylær formel | C21H20O6 |
7-Diethylamino-4-methylcoumarin, 99%
CAS: 91-44-1 Molekylær formel: C14H17NO2 Molekylvægt (g/mol): 231.295 MDL nummer: MFCD00006864 InChI nøgle: AFYCEAFSNDLKSX-UHFFFAOYSA-N Synonym: 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 navn: 7-(diethylamino)-4-methylchromen-2-on SMIL: CCN(CC)C1=CC2=C(C=C1)C(=CC(=O)O2)C
| MDL nummer | MFCD00006864 |
|---|---|
| PubChem CID | 7050 |
| Molekylvægt (g/mol) | 231.295 |
| CAS | 91-44-1 |
| ChEBI | CHEBI:51938 |
| Synonym | 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 |
| SMIL | CCN(CC)C1=CC2=C(C=C1)C(=CC(=O)O2)C |
| IUPAC navn | 7-(diethylamino)-4-methylchromen-2-on |
| InChI nøgle | AFYCEAFSNDLKSX-UHFFFAOYSA-N |
| Molekylær formel | C14H17NO2 |
Phenylbenzoat, 99%
CAS: 93-99-2 Molekylær formel: C13H10O2 Molekylvægt (g/mol): 198.22 MDL nummer: MFCD00003072 InChI nøgle: FCJSHPDYVMKCHI-UHFFFAOYSA-N Synonym: 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 navn: phenylbenzoat SMIL: C1=CC=C(C=C1)C(=O)OC2=CC=CC=C2
| MDL nummer | MFCD00003072 |
|---|---|
| PubChem CID | 7169 |
| Molekylvægt (g/mol) | 198.22 |
| CAS | 93-99-2 |
| ChEBI | CHEBI:86919 |
| Synonym | 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 |
| SMIL | C1=CC=C(C=C1)C(=O)OC2=CC=CC=C2 |
| IUPAC navn | phenylbenzoat |
| InChI nøgle | FCJSHPDYVMKCHI-UHFFFAOYSA-N |
| Molekylær formel | C13H10O2 |
3-(3-Hydroxyphenyl)propionsyre, 98+%
CAS: 621-54-5 Molekylær formel: C9H10O3 Molekylvægt (g/mol): 166.176 MDL nummer: MFCD00016554 InChI nøgle: QVWAEZJXDYOKEH-UHFFFAOYSA-N Synonym: 3-3-hydroxyphenyl propanoic acid,3-3-hydroxyphenyl propionic acid,dihydro-3-coumaric acid,benzenepropanoic acid, 3-hydroxy,3-m-hydroxyphenyl propionic acid,3-hydroxybenzenepropanoic acid,3-hydroxyphenylpropionic acid,m-hydroxyphenylpropionic acid,beta-m-hydroxyphenyl propionic acid,hydrocinnamic acid, m-hydroxy PubChem CID: 91 ChEBI: CHEBI:1427 IUPAC navn: 3-(3-hydroxyphenyl)propansyre SMIL: C1=CC(=CC(=C1)O)CCC(=O)O
| MDL nummer | MFCD00016554 |
|---|---|
| PubChem CID | 91 |
| Molekylvægt (g/mol) | 166.176 |
| CAS | 621-54-5 |
| ChEBI | CHEBI:1427 |
| Synonym | 3-3-hydroxyphenyl propanoic acid,3-3-hydroxyphenyl propionic acid,dihydro-3-coumaric acid,benzenepropanoic acid, 3-hydroxy,3-m-hydroxyphenyl propionic acid,3-hydroxybenzenepropanoic acid,3-hydroxyphenylpropionic acid,m-hydroxyphenylpropionic acid,beta-m-hydroxyphenyl propionic acid,hydrocinnamic acid, m-hydroxy |
| SMIL | C1=CC(=CC(=C1)O)CCC(=O)O |
| IUPAC navn | 3-(3-hydroxyphenyl)propansyre |
| InChI nøgle | QVWAEZJXDYOKEH-UHFFFAOYSA-N |
| Molekylær formel | C9H10O3 |
3-(3,4-dihydroxyphenyl)propionsyre, 98+%
CAS: 1078-61-1 Molekylær formel: C9H10O4 Molekylvægt (g/mol): 182.175 MDL nummer: MFCD00002776 InChI nøgle: DZAUWHJDUNRCTF-UHFFFAOYSA-N Synonym: dihydrocaffeic acid,3-3,4-dihydroxyphenyl propionic acid,hydrocaffeic acid,3,4-dihydroxyhydrocinnamic acid,3-3,4-dihydroxyphenyl propanoic acid,benzenepropanoic acid, 3,4-dihydroxy,hydrocaffeic acid polymer,hykop,3,4-dihydroxyhydrocinnamate,3,4-dihydroxybenzenepropionic acid PubChem CID: 348154 ChEBI: CHEBI:48400 IUPAC navn: 3-(3,4-dihydroxyphenyl)propansyre SMIL: C1=CC(=C(C=C1CCC(=O)O)O)O
| MDL nummer | MFCD00002776 |
|---|---|
| PubChem CID | 348154 |
| Molekylvægt (g/mol) | 182.175 |
| CAS | 1078-61-1 |
| ChEBI | CHEBI:48400 |
| Synonym | dihydrocaffeic acid,3-3,4-dihydroxyphenyl propionic acid,hydrocaffeic acid,3,4-dihydroxyhydrocinnamic acid,3-3,4-dihydroxyphenyl propanoic acid,benzenepropanoic acid, 3,4-dihydroxy,hydrocaffeic acid polymer,hykop,3,4-dihydroxyhydrocinnamate,3,4-dihydroxybenzenepropionic acid |
| SMIL | C1=CC(=C(C=C1CCC(=O)O)O)O |
| IUPAC navn | 3-(3,4-dihydroxyphenyl)propansyre |
| InChI nøgle | DZAUWHJDUNRCTF-UHFFFAOYSA-N |
| Molekylær formel | C9H10O4 |
4-isobutyl-alfa-methylphenyleddikesyre, 99 %
CAS: 15687-27-1 Molekylær formel: C13H18O2 Molekylvægt (g/mol): 206.29 MDL nummer: MFCD00010393 InChI nøgle: HEFNNWSXXWATRW-UHFFFAOYNA-N Synonym: ibuprofen,2-4-isobutylphenyl propanoic acid,motrin,brufen,nurofen,advil,dolgit,liptan,nuprin,anflagen PubChem CID: 3672 ChEBI: CHEBI:5855 IUPAC navn: 2-[4-(2-methylpropyl)phenyl]propansyre SMIL: CC(C)CC1=CC=C(C=C1)C(C)C(O)=O
| MDL nummer | MFCD00010393 |
|---|---|
| PubChem CID | 3672 |
| Molekylvægt (g/mol) | 206.29 |
| CAS | 15687-27-1 |
| ChEBI | CHEBI:5855 |
| Synonym | ibuprofen,2-4-isobutylphenyl propanoic acid,motrin,brufen,nurofen,advil,dolgit,liptan,nuprin,anflagen |
| SMIL | CC(C)CC1=CC=C(C=C1)C(C)C(O)=O |
| IUPAC navn | 2-[4-(2-methylpropyl)phenyl]propansyre |
| InChI nøgle | HEFNNWSXXWATRW-UHFFFAOYNA-N |
| Molekylær formel | C13H18O2 |
Ibuprofen, 99%, Thermo Scientific Chemicals
CAS: 15687-27-1 Molekylær formel: C13H18O2 Molekylvægt (g/mol): 206.29 MDL nummer: MFCD00010393 InChI nøgle: HEFNNWSXXWATRW-UHFFFAOYNA-N PubChem CID: 3672 ChEBI: CHEBI:5855 IUPAC navn: 2-[4-(2-methylpropyl)phenyl]propansyre SMIL: CC(C)CC1=CC=C(C=C1)C(C)C(O)=O
| MDL nummer | MFCD00010393 |
|---|---|
| PubChem CID | 3672 |
| Molekylvægt (g/mol) | 206.29 |
| CAS | 15687-27-1 |
| ChEBI | CHEBI:5855 |
| SMIL | CC(C)CC1=CC=C(C=C1)C(C)C(O)=O |
| IUPAC navn | 2-[4-(2-methylpropyl)phenyl]propansyre |
| InChI nøgle | HEFNNWSXXWATRW-UHFFFAOYNA-N |
| Molekylær formel | C13H18O2 |
Paraffin, flydende, ren
CAS: 8012-95-1 Molekylær formel: MFCD00131611 Molekylvægt (g/mol): 0.00 MDL nummer: MFCD00131611 InChI nøgle: 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 navn: 2-(3,4,5-trihydroxyphenyl)chromenylium-3,5,7-triol;chlorid SMIL: *
| MDL nummer | MFCD00131611 |
|---|---|
| PubChem CID | 68245 |
| Molekylvægt (g/mol) | 0.00 |
| CAS | 8012-95-1 |
| ChEBI | CHEBI:38701 |
| 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 |
| SMIL | * |
| IUPAC navn | 2-(3,4,5-trihydroxyphenyl)chromenylium-3,5,7-triol;chlorid |
| InChI nøgle | FFNDMZIBVDSQFI-UHFFFAOYSA-N |
| Molekylær formel | MFCD00131611 |