Fenilpropanoides y policétidos
Fenilpropanoides y policétidos
Resultados de la búsqueda filtrada
Hidrato de Rutina, + 97 %, Thermo Scientific Chemicals
CAS: 207671-50-9 Fórmula molecular: C27H30O16 Peso molecular (g/mol): 610.52 Número MDL: MFCD01319140 Clave InChI: IKGXIBQEEMLURG-NVPNHPEKSA-N Sinónimo: rutin,rutoside,phytomelin,quercetin 3-rutinoside,birutan,eldrin,myrticolorin,venoruton,3-rutinosyl quercetin,bioflavonoid PubChem CID: 5280805 ChEBI: CHEBI:28527 Nombre IUPAC: 2-(3,4-dihidroxifenil)-5,7-dihidroxi-3-[(2S,3R,4S,5S,6R)-3,4,5-trihidroxi-6-[[(2R,3R,4R,5R,6S)-3,4,5-trihidroxi-6-metiloxan-2-il]oximetil]oxan-2-il]oxicromen-4-ona 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
Sinónimo | rutin,rutoside,phytomelin,quercetin 3-rutinoside,birutan,eldrin,myrticolorin,venoruton,3-rutinosyl quercetin,bioflavonoid |
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Clave InChI | IKGXIBQEEMLURG-NVPNHPEKSA-N |
PubChem CID | 5280805 |
Fórmula molecular | C27H30O16 |
CAS | 207671-50-9 |
ChEBI | CHEBI:28527 |
Peso molecular (g/mol) | 610.52 |
Número MDL | MFCD01319140 |
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 |
Nombre IUPAC | 2-(3,4-dihidroxifenil)-5,7-dihidroxi-3-[(2S,3R,4S,5S,6R)-3,4,5-trihidroxi-6-[[(2R,3R,4R,5R,6S)-3,4,5-trihidroxi-6-metiloxan-2-il]oximetil]oxan-2-il]oxicromen-4-ona |
(+)-Rutina trihidrato, 97 %, Thermo Scientific Chemicals
CAS: 250249-75-3 Fórmula molecular: C27H36O19 Peso molecular (g/mol): 664.566 Número MDL: MFCD00149490 Clave InChI: NLLBWFFSGHKUSY-JPRRWYCFSA-N Sinónimo: 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 Nombre IUPAC: 2-(3,4-dihidroxifenil)-5,7-dihidroxi-3-[(2S,3R,4S,5S,6R)-3,4,5-trihidroxi-6-[[(2R,3R,4R,5R,6S)-3,4,5-trihidroxi-6-metiloxan-2-il]oximetil]oxan-2-il]oxicromen-4-ona; trihidrato SMILES: 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
Sinónimo | 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 |
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Clave InChI | NLLBWFFSGHKUSY-JPRRWYCFSA-N |
PubChem CID | 16218542 |
Fórmula molecular | C27H36O19 |
CAS | 250249-75-3 |
Peso molecular (g/mol) | 664.566 |
Número MDL | MFCD00149490 |
SMILES | 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 |
Nombre IUPAC | 2-(3,4-dihidroxifenil)-5,7-dihidroxi-3-[(2S,3R,4S,5S,6R)-3,4,5-trihidroxi-6-[[(2R,3R,4R,5R,6S)-3,4,5-trihidroxi-6-metiloxan-2-il]oximetil]oxan-2-il]oxicromen-4-ona; trihidrato |
Alcohol cinamílico, 98 % trans, Thermo Scientific Chemicals
CAS: 104-54-1 Fórmula molecular: C9H10O Peso molecular (g/mol): 134.18 Número MDL: MFCD00002921 Clave InChI: OOCCDEMITAIZTP-QPJJXVBHSA-N Sinónimo: cinnamyl alcohol,cinnamic alcohol,3-phenyl-2-propen-1-ol,3-phenylprop-2-en-1-ol,zimtalcohol,styryl carbinol,e-3-phenylprop-2-en-1-ol,3-phenylallyl alcohol,trans-cinnamyl alcohol,styryl alcohol PubChem CID: 5315892 ChEBI: CHEBI:33227 Nombre IUPAC: (E)-3-fenilprop-2-en-1-ol SMILES: C1=CC=C(C=C1)C=CCO
Sinónimo | cinnamyl alcohol,cinnamic alcohol,3-phenyl-2-propen-1-ol,3-phenylprop-2-en-1-ol,zimtalcohol,styryl carbinol,e-3-phenylprop-2-en-1-ol,3-phenylallyl alcohol,trans-cinnamyl alcohol,styryl alcohol |
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Clave InChI | OOCCDEMITAIZTP-QPJJXVBHSA-N |
PubChem CID | 5315892 |
Fórmula molecular | C9H10O |
CAS | 104-54-1 |
ChEBI | CHEBI:33227 |
Peso molecular (g/mol) | 134.18 |
Número MDL | MFCD00002921 |
SMILES | C1=CC=C(C=C1)C=CCO |
Nombre IUPAC | (E)-3-fenilprop-2-en-1-ol |
Ibuprofeno, 99 %, Thermo Scientific Chemicals
CAS: 15687-27-1 Fórmula molecular: C13H18O2 Peso molecular (g/mol): 206.29 Número MDL: MFCD00010393 Clave InChI: HEFNNWSXXWATRW-UHFFFAOYNA-N PubChem CID: 3672 ChEBI: CHEBI:5855 Nombre IUPAC: ácido 2-[4-(2-metilpropil)fenil]propanoico SMILES: CC(C)CC1=CC=C(C=C1)C(C)C(O)=O
Clave InChI | HEFNNWSXXWATRW-UHFFFAOYNA-N |
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PubChem CID | 3672 |
Fórmula molecular | C13H18O2 |
CAS | 15687-27-1 |
ChEBI | CHEBI:5855 |
Peso molecular (g/mol) | 206.29 |
Número MDL | MFCD00010393 |
SMILES | CC(C)CC1=CC=C(C=C1)C(C)C(O)=O |
Nombre IUPAC | ácido 2-[4-(2-metilpropil)fenil]propanoico |
trans-Cinamaldehído, 99 %, Thermo Scientific Chemicals
CAS: 14371-10-9 Fórmula molecular: C9H8O Peso molecular (g/mol): 132.16 Número MDL: MFCD00007000 Clave InChI: KJPRLNWUNMBNBZ-QPJJXVBHSA-N Sinónimo: 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
Sinónimo | cinnamaldehyde,trans-cinnamaldehyde,cinnamic aldehyde,e-cinnamaldehyde,cinnamal,3-phenylacrylaldehyde,zimtaldehyde,cinnamylaldehyde,3-phenylpropenal,2e-3-phenylprop-2-enal |
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Clave InChI | KJPRLNWUNMBNBZ-QPJJXVBHSA-N |
PubChem CID | 637511 |
Fórmula molecular | C9H8O |
CAS | 14371-10-9 |
ChEBI | CHEBI:16731 |
Peso molecular (g/mol) | 132.16 |
Número MDL | MFCD00007000 |
SMILES | O=C\C=C\C1=CC=CC=C1 |
trans-Cinamaldehído, ≥98 %, Thermo Scientific Chemicals
CAS: 14371-10-9 Fórmula molecular: C9H8O Peso molecular (g/mol): 132.16 Número MDL: MFCD00007000 Clave InChI: KJPRLNWUNMBNBZ-QPJJXVBHSA-N Sinónimo: 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
Sinónimo | cinnamaldehyde,trans-cinnamaldehyde,cinnamic aldehyde,e-cinnamaldehyde,cinnamal,3-phenylacrylaldehyde,zimtaldehyde,cinnamylaldehyde,3-phenylpropenal,2e-3-phenylprop-2-enal |
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Clave InChI | KJPRLNWUNMBNBZ-QPJJXVBHSA-N |
PubChem CID | 637511 |
Fórmula molecular | C9H8O |
CAS | 14371-10-9 |
ChEBI | CHEBI:16731 |
Peso molecular (g/mol) | 132.16 |
Número MDL | MFCD00007000 |
SMILES | O=C\C=C\C1=CC=CC=C1 |
7-Hidrocumarina, 99 %, Thermo Scientific Chemicals
CAS: 93-35-6 Fórmula molecular: C9H6O3 Peso molecular (g/mol): 162.14 Número MDL: MFCD00006878 Clave InChI: ORHBXUUXSCNDEV-UHFFFAOYSA-N Sinónimo: 7-hydroxycoumarin,umbelliferone,7-hydroxy-2h-chromen-2-one,hydrangin,skimmetin,7-hydroxycoumarine,7-oxycoumarin,hydrangine,skimmetine,umbelliferon PubChem CID: 5281426 ChEBI: CHEBI:27510 SMILES: OC1=CC=C2C=CC(=O)OC2=C1
Sinónimo | 7-hydroxycoumarin,umbelliferone,7-hydroxy-2h-chromen-2-one,hydrangin,skimmetin,7-hydroxycoumarine,7-oxycoumarin,hydrangine,skimmetine,umbelliferon |
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Clave InChI | ORHBXUUXSCNDEV-UHFFFAOYSA-N |
PubChem CID | 5281426 |
Fórmula molecular | C9H6O3 |
CAS | 93-35-6 |
ChEBI | CHEBI:27510 |
Peso molecular (g/mol) | 162.14 |
Número MDL | MFCD00006878 |
SMILES | OC1=CC=C2C=CC(=O)OC2=C1 |
Hidrato de morina, Thermo Scientific Chemicals
CAS: 654055-01-3 Fórmula molecular: C15H10O7 Peso molecular (g/mol): 302.24 Número MDL: MFCD00217054 Clave InChI: YXOLAZRVSSWPPT-UHFFFAOYSA-N Sinónimo: morin hydrate,morinhydrate,bois d,arc hydrate,2-2,4-dihydroxyphenyl-3,5,7-trihydroxy-4h-chromen-4-one hydrate,morin hydrate, powder,morin flavonol,morin hydrate aurantica,2-2,4-dihydroxyphenyl-3,5,7-trihydroxy-chromen-4-one hydrate,2 inverted exclamation marka,3,4 inverted exclamation marka,5,7-pentahydroxyflavone PubChem CID: 16219651 Nombre IUPAC: 2-(2,4-dihydroxyphenyl)-3,5,7-trihydroxy-4H-chromen-4-one SMILES: OC1=CC(O)=C(C=C1)C1=C(O)C(=O)C2=C(O)C=C(O)C=C2O1
Sinónimo | morin hydrate,morinhydrate,bois d,arc hydrate,2-2,4-dihydroxyphenyl-3,5,7-trihydroxy-4h-chromen-4-one hydrate,morin hydrate, powder,morin flavonol,morin hydrate aurantica,2-2,4-dihydroxyphenyl-3,5,7-trihydroxy-chromen-4-one hydrate,2 inverted exclamation marka,3,4 inverted exclamation marka,5,7-pentahydroxyflavone |
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Clave InChI | YXOLAZRVSSWPPT-UHFFFAOYSA-N |
PubChem CID | 16219651 |
Fórmula molecular | C15H10O7 |
CAS | 654055-01-3 |
Peso molecular (g/mol) | 302.24 |
Número MDL | MFCD00217054 |
SMILES | OC1=CC(O)=C(C=C1)C1=C(O)C(=O)C2=C(O)C=C(O)C=C2O1 |
Nombre IUPAC | 2-(2,4-dihydroxyphenyl)-3,5,7-trihydroxy-4H-chromen-4-one |
Ácido trans-4-hidroxi-3-metoxicinámico, 99 %, Thermo Scientific Chemicals
CAS: 537-98-4 Fórmula molecular: C10H10O4 Peso molecular (g/mol): 194.19 Número MDL: MFCD00004400 Clave InChI: KSEBMYQBYZTDHS-HWKANZROSA-N Sinónimo: 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 Nombre IUPAC: (2E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoic acid SMILES: COC1=CC(\C=C\C(O)=O)=CC=C1O
Sinónimo | 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 |
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Clave InChI | KSEBMYQBYZTDHS-HWKANZROSA-N |
PubChem CID | 445858 |
Fórmula molecular | C10H10O4 |
CAS | 537-98-4 |
ChEBI | CHEBI:17620 |
Peso molecular (g/mol) | 194.19 |
Número MDL | MFCD00004400 |
SMILES | COC1=CC(\C=C\C(O)=O)=CC=C1O |
Nombre IUPAC | (2E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoic acid |
Hidrato de esculina, 97 %, Thermo Scientific Chemicals
CAS: 531-75-9 Fórmula molecular: C15H16O9 Peso molecular (g/mol): 340.28 Número MDL: MFCD00149492 Clave InChI: XHCADAYNFIFUHF-TYKRLAFXNA-N Sinónimo: 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 Nombre IUPAC: 7-hydroxy-6-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-2H-chromen-2-one SMILES: OC[C@H]1O[C@@H](OC2=C(O)C=C3OC(=O)C=CC3=C2)[C@H](O)[C@@H](O)[C@@H]1O
Sinónimo | esculin,aesculin,esculoside,--esculin,polychrome,6,7-dihydroxycoumarin-6-o-glucoside,aesculinum,esculine,esculetin 6-o-glucoside,6,7-dihydroxycoumarin 6-glucoside |
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Clave InChI | XHCADAYNFIFUHF-TYKRLAFXNA-N |
PubChem CID | 5281417 |
Fórmula molecular | C15H16O9 |
CAS | 531-75-9 |
ChEBI | CHEBI:4853 |
Peso molecular (g/mol) | 340.28 |
Número MDL | MFCD00149492 |
SMILES | OC[C@H]1O[C@@H](OC2=C(O)C=C3OC(=O)C=CC3=C2)[C@H](O)[C@@H](O)[C@@H]1O |
Nombre IUPAC | 7-hydroxy-6-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-2H-chromen-2-one |
4-Metilumbeliferil fosfato, 99 %, Thermo Scientific Chemicals
CAS: 3368-04-5 Número MDL: MFCD00016969
CAS | 3368-04-5 |
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Número MDL | MFCD00016969 |
4-Metoxicoumarina, 98 %, Thermo Scientific Chemicals
CAS: 20280-81-3 Fórmula molecular: C10H8O3 Peso molecular (g/mol): 176.171 Número MDL: MFCD00017349 Clave InChI: MLCMXDYMSAZNPC-UHFFFAOYSA-N PubChem CID: 529426 Nombre IUPAC: 4-metoxicromen-2-ona SMILES: COC1=CC(=O)OC2=CC=CC=C21
Clave InChI | MLCMXDYMSAZNPC-UHFFFAOYSA-N |
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PubChem CID | 529426 |
Fórmula molecular | C10H8O3 |
CAS | 20280-81-3 |
Peso molecular (g/mol) | 176.171 |
Número MDL | MFCD00017349 |
SMILES | COC1=CC(=O)OC2=CC=CC=C21 |
Nombre IUPAC | 4-metoxicromen-2-ona |
3',5,7-Trihidroxi-4'-metoxiflavanona, 97 %, Thermo Scientific Chemicals
CAS: 520-33-2 Fórmula molecular: C16H14O6 Peso molecular (g/mol): 302.28 Número MDL: MFCD00075646 Clave InChI: AIONOLUJZLIMTK-AWEZNQCLSA-N Sinónimo: hesperetin,hesperitin,3',5,7-trihydroxy-4'-methoxyflavanone,hesperin,yso2,cyanidanon 4'-methyl ether 1626,5,7,3'-trihydroxy-4'-methoxyflavanone,--hesperetin,prestwick_908,unii-q9q3d557f1 PubChem CID: 72281 ChEBI: CHEBI:28230 Nombre IUPAC: (2S)-5,7-dihidroxi-2-(3-hidroxi-4-metoxifenil)-2,3-dihidrocromen-4-ona SMILES: COC1=CC=C(C=C1O)[C@@H]1CC(=O)C2=C(O)C=C(O)C=C2O1
Sinónimo | hesperetin,hesperitin,3',5,7-trihydroxy-4'-methoxyflavanone,hesperin,yso2,cyanidanon 4'-methyl ether 1626,5,7,3'-trihydroxy-4'-methoxyflavanone,--hesperetin,prestwick_908,unii-q9q3d557f1 |
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Clave InChI | AIONOLUJZLIMTK-AWEZNQCLSA-N |
PubChem CID | 72281 |
Fórmula molecular | C16H14O6 |
CAS | 520-33-2 |
ChEBI | CHEBI:28230 |
Peso molecular (g/mol) | 302.28 |
Número MDL | MFCD00075646 |
SMILES | COC1=CC=C(C=C1O)[C@@H]1CC(=O)C2=C(O)C=C(O)C=C2O1 |
Nombre IUPAC | (2S)-5,7-dihidroxi-2-(3-hidroxi-4-metoxifenil)-2,3-dihidrocromen-4-ona |
Salicilato de fenil, 99 %, Thermo Scientific Chemicals
CAS: 118-55-8 Fórmula molecular: C13H10O3 Peso molecular (g/mol): 214.22 Clave InChI: ZQBAKBUEJOMQEX-UHFFFAOYSA-N Sinónimo: 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 Nombre IUPAC: fenil 2-hidroxibenzoato SMILES: C1=CC=C(C=C1)OC(=O)C2=CC=CC=C2O
Sinónimo | 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 |
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Clave InChI | ZQBAKBUEJOMQEX-UHFFFAOYSA-N |
PubChem CID | 8361 |
Fórmula molecular | C13H10O3 |
CAS | 118-55-8 |
ChEBI | CHEBI:34918 |
Peso molecular (g/mol) | 214.22 |
SMILES | C1=CC=C(C=C1)OC(=O)C2=CC=CC=C2O |
Nombre IUPAC | fenil 2-hidroxibenzoato |
Ácido 3-fenilpropiónico, 99 %, Thermo Scientific Chemicals
CAS: 501-52-0 Fórmula molecular: C9H10O2 Peso molecular (g/mol): 150.177 Número MDL: MFCD00002771 Clave InChI: XMIIGOLPHOKFCH-UHFFFAOYSA-N Sinónimo: hydrocinnamic acid,3-phenylpropionic acid,benzylacetic acid,benzenepropanoic acid,dihydrocinnamic acid,benzenepropionic acid,phenylpropanoic acid,3-phenyl-propionic acid,phenylpropanoate,beta-phenylpropionic acid PubChem CID: 107 ChEBI: CHEBI:28631 Nombre IUPAC: ácido 3-fenilpropanoico SMILES: C1=CC=C(C=C1)CCC(=O)O
Sinónimo | hydrocinnamic acid,3-phenylpropionic acid,benzylacetic acid,benzenepropanoic acid,dihydrocinnamic acid,benzenepropionic acid,phenylpropanoic acid,3-phenyl-propionic acid,phenylpropanoate,beta-phenylpropionic acid |
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Clave InChI | XMIIGOLPHOKFCH-UHFFFAOYSA-N |
PubChem CID | 107 |
Fórmula molecular | C9H10O2 |
CAS | 501-52-0 |
ChEBI | CHEBI:28631 |
Peso molecular (g/mol) | 150.177 |
Número MDL | MFCD00002771 |
SMILES | C1=CC=C(C=C1)CCC(=O)O |
Nombre IUPAC | ácido 3-fenilpropanoico |