Phenylpropanoider og polyketider
Filtrerede søgeresultater
4-Isobutyl-alpha-methylphenylacetic acid, 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 |
1,3-diphenylacetone, 99 %, Thermo Scientific Chemicals
CAS: 102-04-5 Molekylær formel: C15H14O Molekylvægt (g/mol): 210.28 MDL nummer: MFCD00004795 InChI nøgle: YFKBXYGUSOXJGS-UHFFFAOYSA-N Synonym: 1,3-diphenylacetone,dibenzyl ketone,1,3-diphenyl-2-propanone,benzyl ketone,2-propanone, 1,3-diphenyl,1,3-diphenylpropanone,alpha,alpha'-diphenylacetone,1,3-diphenyl-propan-2-one,unii-9y07g5udkq,fema no. 2397 PubChem CID: 7593 IUPAC navn: 1,3-diphenylpropan-2-on SMIL: O=C(CC1=CC=CC=C1)CC1=CC=CC=C1
| MDL nummer | MFCD00004795 |
|---|---|
| PubChem CID | 7593 |
| Molekylvægt (g/mol) | 210.28 |
| CAS | 102-04-5 |
| Synonym | 1,3-diphenylacetone,dibenzyl ketone,1,3-diphenyl-2-propanone,benzyl ketone,2-propanone, 1,3-diphenyl,1,3-diphenylpropanone,alpha,alpha'-diphenylacetone,1,3-diphenyl-propan-2-one,unii-9y07g5udkq,fema no. 2397 |
| SMIL | O=C(CC1=CC=CC=C1)CC1=CC=CC=C1 |
| IUPAC navn | 1,3-diphenylpropan-2-on |
| InChI nøgle | YFKBXYGUSOXJGS-UHFFFAOYSA-N |
| Molekylær formel | C15H14O |
Nujol, til IR-spektroskopi, Thermo Scientific Chemicals
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 Hydrat, 97+%, Thermo Scientific Chemicals
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 |
4-methylumbelliferon, 97 %, Thermo Scientific Chemicals
CAS: 90-33-5 Molekylær formel: C10H8O3 Molekylvægt (g/mol): 176.17 MDL nummer: MFCD00006866 InChI nøgle: HSHNITRMYYLLCV-UHFFFAOYSA-N Synonym: 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 navn: 7-hydroxy-4-methylchromen-2-on SMIL: CC1=CC(=O)OC2=CC(O)=CC=C12
| MDL nummer | MFCD00006866 |
|---|---|
| PubChem CID | 5280567 |
| Molekylvægt (g/mol) | 176.17 |
| CAS | 90-33-5 |
| ChEBI | CHEBI:17224 |
| Synonym | 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 |
| SMIL | CC1=CC(=O)OC2=CC(O)=CC=C12 |
| IUPAC navn | 7-hydroxy-4-methylchromen-2-on |
| InChI nøgle | HSHNITRMYYLLCV-UHFFFAOYSA-N |
| Molekylær formel | C10H8O3 |
Curcumin (blanding af curcumin, demethoxycurcumin og bisdemethoxycurcumin), 96%, Thermo Scientific Chemicals
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 |
Dihydrocoumarin, 99%
CAS: 119-84-6 Molekylær formel: C9H8O2 Molekylvægt (g/mol): 148.161 MDL nummer: MFCD00006881 InChI nøgle: VMUXSMXIQBNMGZ-UHFFFAOYSA-N Synonym: dihydrocoumarin,3,4-dihydrocoumarin,hydrocoumarin,chroman-2-one,benzodihydropyrone,melilotin,melilotol,2-chromanone,1,2-benzodihydropyrone,melilotic lactone PubChem CID: 660 ChEBI: CHEBI:16151 IUPAC navn: 3,4-dihydrochromen-2-on SMIL: C1CC(=O)OC2=CC=CC=C21
| MDL nummer | MFCD00006881 |
|---|---|
| PubChem CID | 660 |
| Molekylvægt (g/mol) | 148.161 |
| CAS | 119-84-6 |
| ChEBI | CHEBI:16151 |
| Synonym | dihydrocoumarin,3,4-dihydrocoumarin,hydrocoumarin,chroman-2-one,benzodihydropyrone,melilotin,melilotol,2-chromanone,1,2-benzodihydropyrone,melilotic lactone |
| SMIL | C1CC(=O)OC2=CC=CC=C21 |
| IUPAC navn | 3,4-dihydrochromen-2-on |
| InChI nøgle | VMUXSMXIQBNMGZ-UHFFFAOYSA-N |
| Molekylær formel | C9H8O2 |
trans-Cinnamaldehyde, 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 |
Paraffinvæske, teknisk, d=0,88, til oliebade, Fisher Chemical™
CAS: 8042-47-5 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 | 8042-47-5 |
| 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 |
Paraffin, liquid, pure
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 |
Curcumin, 95% (total curcuminoid content), from Turmeric rhizome
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 |
Paraffinvoks, ren, granulær, ACROS Organics™
CAS: 8002-74-2 Molekylær formel: CnH2n+2 Molekylvægt (g/mol): 341.451 MDL nummer: MFCD00132833 InChI nøgle: JWHAUXFOSRPERK-UHFFFAOYSA-N Synonym: propafenone,rythmol,propafenona,propafenonum,propafenonum inn-latin,propafenona inn-spanish,propafenone inn:ban,gnf-pf-4594,propafenone-hcl,propafenone inn PubChem CID: 4932 ChEBI: CHEBI:63619 IUPAC navn: 1-[2-[2-hydroxy-3-(propylamino)propoxy]phenyl]-3-phenylpropan-1-on SMIL: CCCNCC(COC1=CC=CC=C1C(=O)CCC2=CC=CC=C2)O
| MDL nummer | MFCD00132833 |
|---|---|
| PubChem CID | 4932 |
| Molekylvægt (g/mol) | 341.451 |
| CAS | 8002-74-2 |
| ChEBI | CHEBI:63619 |
| Synonym | propafenone,rythmol,propafenona,propafenonum,propafenonum inn-latin,propafenona inn-spanish,propafenone inn:ban,gnf-pf-4594,propafenone-hcl,propafenone inn |
| SMIL | CCCNCC(COC1=CC=CC=C1C(=O)CCC2=CC=CC=C2)O |
| IUPAC navn | 1-[2-[2-hydroxy-3-(propylamino)propoxy]phenyl]-3-phenylpropan-1-on |
| InChI nøgle | JWHAUXFOSRPERK-UHFFFAOYSA-N |
| Molekylær formel | CnH2n+2 |
Phenyl salicylate, 99%
CAS: 118-55-8 Molekylær formel: C13H10O3 Molekylvægt (g/mol): 214.22 InChI nøgle: ZQBAKBUEJOMQEX-UHFFFAOYSA-N Synonym: phenyl salicylate,salol,phenol salicylate,salphenyl,musol,2-phenoxycarbonylphenol,benzoic acid, 2-hydroxy-, phenyl ester,salicylic acid, phenyl ester,2-hydroxybenzoic acid phenyl ester,phenyl-2-hydroxybenzoate PubChem CID: 8361 ChEBI: CHEBI:34918 IUPAC navn: phenyl-2-hydroxybenzoat SMIL: C1=CC=C(C=C1)OC(=O)C2=CC=CC=C2O
| PubChem CID | 8361 |
|---|---|
| Molekylvægt (g/mol) | 214.22 |
| CAS | 118-55-8 |
| ChEBI | CHEBI:34918 |
| Synonym | phenyl salicylate,salol,phenol salicylate,salphenyl,musol,2-phenoxycarbonylphenol,benzoic acid, 2-hydroxy-, phenyl ester,salicylic acid, phenyl ester,2-hydroxybenzoic acid phenyl ester,phenyl-2-hydroxybenzoate |
| SMIL | C1=CC=C(C=C1)OC(=O)C2=CC=CC=C2O |
| IUPAC navn | phenyl-2-hydroxybenzoat |
| InChI nøgle | ZQBAKBUEJOMQEX-UHFFFAOYSA-N |
| Molekylær formel | C13H10O3 |
Esculin hydrate, 97%
CAS: 531-75-9 Molekylær formel: C15H16O9 Molekylvægt (g/mol): 340.28 MDL nummer: MFCD00149492 InChI nøgle: XHCADAYNFIFUHF-TYKRLAFXNA-N Synonym: esculin,aesculin,esculoside,--esculin,polychrome,6,7-dihydroxycoumarin-6-o-glucoside,aesculinum,esculine,esculetin 6-o-glucoside,6,7-dihydroxycoumarin 6-glucoside PubChem CID: 5281417 ChEBI: CHEBI:4853 IUPAC navn: 7-hydroxy-6-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-2-on SMIL: OC[C@H]1O[C@@H](OC2=C(O)C=C3OC(=O)C=CC3=C2)[C@H](O)[C@@H](O)[C@@H]1O
| MDL nummer | MFCD00149492 |
|---|---|
| PubChem CID | 5281417 |
| Molekylvægt (g/mol) | 340.28 |
| CAS | 531-75-9 |
| ChEBI | CHEBI:4853 |
| Synonym | esculin,aesculin,esculoside,--esculin,polychrome,6,7-dihydroxycoumarin-6-o-glucoside,aesculinum,esculine,esculetin 6-o-glucoside,6,7-dihydroxycoumarin 6-glucoside |
| SMIL | OC[C@H]1O[C@@H](OC2=C(O)C=C3OC(=O)C=CC3=C2)[C@H](O)[C@@H](O)[C@@H]1O |
| IUPAC navn | 7-hydroxy-6-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-2-on |
| InChI nøgle | XHCADAYNFIFUHF-TYKRLAFXNA-N |
| Molekylær formel | C15H16O9 |
Thermo Scientific Chemicals 4-dimethylaminokanelaldehyd, 98 %
CAS: 6203-18-5 Molekylær formel: C11H13NO Molekylvægt (g/mol): 175.23 MDL nummer: MFCD00007002 InChI nøgle: RUKJCCIJLIMGEP-ONEGZZNKSA-N Synonym: 4-dimethylamino cinnamaldehyde,4-dimethylaminocinnamaldehyde,p-dimethylaminocinnamaldehyde,3-4-dimethylamino phenyl acrylaldehyde,4-dimethylcinnamaldehyde,p-dimethylaminocinnamic aldehyde,p-dimethylamino cinnamaldehyde,cinnamaldehyde, p-dimethylamino,unii-9rsi7wz9f0,dmaca reagent PubChem CID: 5284506 IUPAC navn: (E)-3-[4-(dimethylamino)phenyl]prop-2-enal SMIL: CN(C)C1=CC=C(C=C1)C=CC=O
| MDL nummer | MFCD00007002 |
|---|---|
| PubChem CID | 5284506 |
| Molekylvægt (g/mol) | 175.23 |
| CAS | 6203-18-5 |
| Synonym | 4-dimethylamino cinnamaldehyde,4-dimethylaminocinnamaldehyde,p-dimethylaminocinnamaldehyde,3-4-dimethylamino phenyl acrylaldehyde,4-dimethylcinnamaldehyde,p-dimethylaminocinnamic aldehyde,p-dimethylamino cinnamaldehyde,cinnamaldehyde, p-dimethylamino,unii-9rsi7wz9f0,dmaca reagent |
| SMIL | CN(C)C1=CC=C(C=C1)C=CC=O |
| IUPAC navn | (E)-3-[4-(dimethylamino)phenyl]prop-2-enal |
| InChI nøgle | RUKJCCIJLIMGEP-ONEGZZNKSA-N |
| Molekylær formel | C11H13NO |