Phenylpropanoids and polyketides
Thermo Scientific Chemicals 4-Dimethylaminocinnamaldehyde, 98%
CAS: 6203-18-5 Formule moléculaire: C11H13NO Poids moléculaire (g/mol): 175.23 Numéro MDL: MFCD00007002 Clé InChI: RUKJCCIJLIMGEP-ONEGZZNKSA-N Synonyme: 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 CID PubChem: 5284506 Nom IUPAC: (E)-3-[4-(dimethylamino)phenyl]prop-2-enal SMILES: CN(C)C1=CC=C(C=C1)C=CC=O
alpha-Bromocinnamaldehyde, 98%
CAS: 5443-49-2 Formule moléculaire: C9H7BrO Poids moléculaire (g/mol): 211.058 Numéro MDL: MFCD00006965 Clé InChI: WQRWNOKNRHCLHV-TWGQIWQCSA-N Synonyme: alpha-bromocinnamaldehyde,2-bromo-3-phenylacrylaldehyde,alphabrocine,2-bromo-3-phenyl-2-propenal,bromocinnamal,alpha-bromocinnamic aldehyde,ccris 3924,b 37 van,2-propenal, 2-bromo-3-phenyl,cinnamaldehyde, alpha-bromo CID PubChem: 5369403 Nom IUPAC: (Z)-2-bromo-3-phenylprop-2-enal SMILES: C1=CC=C(C=C1)C=C(C=O)Br
trans-Cinnamaldehyde, 99%
CAS: 14371-10-9 Formule moléculaire: C9H8O Poids moléculaire (g/mol): 132.16 Numéro MDL: MFCD00007000 Clé InChI: KJPRLNWUNMBNBZ-QPJJXVBHSA-N Synonyme: cinnamaldehyde,trans-cinnamaldehyde,cinnamic aldehyde,e-cinnamaldehyde,cinnamal,3-phenylacrylaldehyde,zimtaldehyde,cinnamylaldehyde,3-phenylpropenal,2e-3-phenylprop-2-enal CID PubChem: 637511 ChEBI: CHEBI:16731 SMILES: O=C\C=C\C1=CC=CC=C1
4-Nitrocinnamaldehyde, predominantly trans, 98%
CAS: 1734-79-8 Formule moléculaire: C9H7NO3 Poids moléculaire (g/mol): 177.159 Numéro MDL: MFCD00007379 Clé InChI: ALGQVMMYDWQDEC-OWOJBTEDSA-N Synonyme: 4-nitrocinnamaldehyde,3-4-nitrophenyl acrylaldehyde,p-nitrocinnamaldehyde,2-propenal, 3-4-nitrophenyl,cinnamaldehyde, p-nitro,trans-4-nitrocinnamaldehyde,e-3-4-nitrophenyl acrylaldehyde,3-4-nitrophenyl-2-propenal,unii-48r8lam7yx,2e-3-4-nitrophenyl prop-2-enal CID PubChem: 5354135 Nom IUPAC: (E)-3-(4-nitrophenyl)prop-2-enal SMILES: C1=CC(=CC=C1C=CC=O)[N+](=O)[O-]
trans-Cinnamaldehyde, 98+%
CAS: 14371-10-9 Formule moléculaire: C9H8O Poids moléculaire (g/mol): 132.16 Numéro MDL: MFCD00007000 Clé InChI: KJPRLNWUNMBNBZ-QPJJXVBHSA-N Synonyme: cinnamaldehyde,trans-cinnamaldehyde,cinnamic aldehyde,e-cinnamaldehyde,cinnamal,3-phenylacrylaldehyde,zimtaldehyde,cinnamylaldehyde,3-phenylpropenal,2e-3-phenylprop-2-enal CID PubChem: 637511 ChEBI: CHEBI:16731 SMILES: O=C\C=C\C1=CC=CC=C1
o-Nitrocinnamaldehyde, 98%
CAS: 1466-88-2 Formule moléculaire: C9H7NO3 Poids moléculaire (g/mol): 177.16 Numéro MDL: MFCD00007188 Clé InChI: VMSMELHEXDVEDE-HWKANZROSA-N Synonyme: 2-nitrocinnamaldehyde,3-2-nitrophenyl acrylaldehyde,o-nitrocinnamaldehyde,trans-2-nitrocinnamaldehyde,2e-3-2-nitrophenyl prop-2-enal,2-propenal, 3-2-nitrophenyl,e-3-2-nitrophenyl acrylaldehyde,e-3-2-nitrophenyl prop-2-enal,3-2-nitrophenyl prop-2-enal,ccris 3775 CID PubChem: 5367122 Nom IUPAC: (E)-3-(2-nitrophenyl)prop-2-enal SMILES: C1=CC=C(C(=C1)C=CC=O)[N+](=O)[O-]
alpha-Methylcinnamaldehyde, predominantly (E), 97%
CAS: 101-39-3 Formule moléculaire: C10H10O Poids moléculaire (g/mol): 146.19 Numéro MDL: MFCD00006976 Clé InChI: VLUMOWNVWOXZAU-CLFYSBASSA-N Synonyme: alpha-methylcinnamaldehyde,a-methylcinnamaldehyde,2-propenal, 2-methyl-3-phenyl,2-methyl-3-phenylprop-2-enal,e-2-methyl-3-phenylpropenal,2-methyl-3-phenylacrylaldehyde,e-2-methyl-3-phenylacrylaldehyde,2-methyl-3-phenyl-2-propenal,2-methyl-3-phenylacrolein,alpha-methyl-trans-cinnamaldehyde CID PubChem: 5372813 SMILES: C\C(C=O)=C\C1=CC=CC=C1
Thermo Scientific Chemicals 4-Epioxytetracycline, 'can be used as secondary standard'
CAS: 14206-58-7 Formule moléculaire: C22H24N2O9 Poids moléculaire (g/mol): 460.43 Numéro MDL: MFCD00062825 Clé InChI: OWFJMIVZYSDULZ-DVJPNYBFSA-N Synonyme: 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 CID PubChem: 54678403 Nom IUPAC: (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
Chlortetracycline hydrochloride
CAS: 64-72-2 Formule moléculaire: C22H24Cl2N2O8 Poids moléculaire (g/mol): 515.34 Numéro MDL: MFCD00082440 Clé InChI: QYAPHLRPFNSDNH-CIVPRPTRSA-N Synonyme: chlortetracycline hydrochloride,4-epi-chlortetracycline hydrochloride,2-amino hydroxy methylidene-7-chloro-4-dimethylamino-6,10,11,12a-tetrahydroxy-6-methyl-4,4a,5,5a-tetrahydrotetracene-1,3,12-trione hydrochloride,2-azanyl oxidanyl methylidene-7-chloranyl-4-dimethylamino-6-methyl-6,10,11,12a-tetrakis oxidanyl-4,4a,5,5a-tetrahydrotetracene-1,3,12-trione hydrochloride CID PubChem: 66577600 Nom IUPAC: (4S,4aR,5aS,6S,12aR)-7-chloro-4-(dimethylamino)-1,6,10,11,12a-pentahydroxy-6-methyl-3,12-dioxo-4,4a,5,5a-tetrahydrotetracene-2-carboxamide;hydrochloride SMILES: CC1(C2CC3C(C(=O)C(=C(C3(C(=O)C2=C(C4=C(C=CC(=C41)Cl)O)O)O)O)C(=O)N)N(C)C)O.Cl
Demeclocycline hydrochloride
CAS: 64-73-3 Formule moléculaire: C21H22Cl2N2O8 Poids moléculaire (g/mol): 501.313 Numéro MDL: MFCD00082371 Clé InChI: OAPVUSSHCBRCOL-KBHRXELFSA-N Synonyme: demeclocycline hydrochloride,demeclocycline hcl,declomycin,detravis,ledermycine,clortetrin,ledermycin,ledermicina,veraciclina,demeplus CID PubChem: 54686764 Nom IUPAC: (4S,4aS,5aS,6S,12aR)-7-chloro-4-(dimethylamino)-1,6,10,11,12a-pentahydroxy-3,12-dioxo-4a,5,5a,6-tetrahydro-4H-tetracene-2-carboxamide;hydrochloride SMILES: CN(C)C1C2CC3C(C4=C(C=CC(=C4C(=C3C(=O)C2(C(=C(C1=O)C(=O)N)O)O)O)O)Cl)O.Cl
Chlortetracycline hydrochloride, specified according to the requirements of Ph.Eur.
CAS: 64-72-2 Formule moléculaire: C22H23ClN2O8·HCl Poids moléculaire (g/mol): 515.33 Numéro MDL: MFCD00082440 Clé InChI: QYAPHLRPFNSDNH-CIVPRPTRSA-N Synonyme: chlortetracycline hydrochloride,4-epi-chlortetracycline hydrochloride,2-amino hydroxy methylidene-7-chloro-4-dimethylamino-6,10,11,12a-tetrahydroxy-6-methyl-4,4a,5,5a-tetrahydrotetracene-1,3,12-trione hydrochloride,2-azanyl oxidanyl methylidene-7-chloranyl-4-dimethylamino-6-methyl-6,10,11,12a-tetrakis oxidanyl-4,4a,5,5a-tetrahydrotetracene-1,3,12-trione hydrochloride CID PubChem: 66577600 Nom IUPAC: (4S,4aR,5aS,6S,12aR)-7-chloro-4-(dimethylamino)-1,6,10,11,12a-pentahydroxy-6-methyl-3,12-dioxo-4,4a,5,5a-tetrahydrotetracene-2-carboxamide;hydrochloride SMILES: CC1(C2CC3C(C(=O)C(=C(C3(C(=O)C2=C(C4=C(C=CC(=C41)Cl)O)O)O)O)C(=O)N)N(C)C)O.Cl
4-Dimethylaminocinnamaldehyde, 98%
CAS: 6203-18-5 Formule moléculaire: C11H13NO Poids moléculaire (g/mol): 175.231 Numéro MDL: MFCD00007002 Clé InChI: RUKJCCIJLIMGEP-ONEGZZNKSA-N Synonyme: 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 CID PubChem: 5284506 Nom IUPAC: (E)-3-[4-(dimethylamino)phenyl]prop-2-enal SMILES: CN(C)C1=CC=C(C=C1)C=CC=O
4',7-Dihydroxyisoflavone, 97%
CAS: 486-66-8 Formule moléculaire: C15H10O4 Poids moléculaire (g/mol): 254.241 Numéro MDL: MFCD00016954 Clé InChI: ZQSIJRDFPHDXIC-UHFFFAOYSA-N Synonyme: daidzein,4',7-dihydroxyisoflavone,daidzeol,7,4'-dihydroxyisoflavone,7-hydroxy-3-4-hydroxyphenyl-4h-chromen-4-one,diadzein,7-hydroxy-3-4-hydroxyphenyl-4h-1-benzopyran-4-one,4h-1-benzopyran-4-one, 7-hydroxy-3-4-hydroxyphenyl,7-hydroxy-3-4-hydroxyphenyl chromen-4-one,7-hydroxy-3-4-hydroxyphenyl-4-benzopyrone CID PubChem: 5281708 ChEBI: CHEBI:28197 Nom IUPAC: 7-hydroxy-3-(4-hydroxyphenyl)chromen-4-one SMILES: C1=CC(=CC=C1C2=COC3=C(C2=O)C=CC(=C3)O)O
Daidzein, 98%
CAS: 486-66-8 Formule moléculaire: C15H10O4 Poids moléculaire (g/mol): 254.24 Numéro MDL: MFCD00016954 Clé InChI: ZQSIJRDFPHDXIC-UHFFFAOYSA-N Synonyme: daidzein,4',7-dihydroxyisoflavone,daidzeol,7,4'-dihydroxyisoflavone,7-hydroxy-3-4-hydroxyphenyl-4h-chromen-4-one,diadzein,7-hydroxy-3-4-hydroxyphenyl-4h-1-benzopyran-4-one,4h-1-benzopyran-4-one, 7-hydroxy-3-4-hydroxyphenyl,7-hydroxy-3-4-hydroxyphenyl chromen-4-one,7-hydroxy-3-4-hydroxyphenyl-4-benzopyrone CID PubChem: 5281708 ChEBI: CHEBI:28197 Nom IUPAC: 7-hydroxy-3-(4-hydroxyphenyl)chromen-4-one SMILES: C1=CC(=CC=C1C2=COC3=C(C2=O)C=CC(=C3)O)O
4',5,7-Trihydroxyisoflavone, 99+%
CAS: 446-72-0 Formule moléculaire: C15H10O5 Poids moléculaire (g/mol): 270.24 Numéro MDL: MFCD00016952 Clé InChI: TZBJGXHYKVUXJN-UHFFFAOYSA-N Synonyme: genistein,prunetol,genisteol,4',5,7-trihydroxyisoflavone,genisterin,sophoricol,5,7,4'-trihydroxyisoflavone,bonistein,5,7-dihydroxy-3-4-hydroxyphenyl-4h-chromen-4-one,genestein CID PubChem: 5280961 ChEBI: CHEBI:28088 Nom IUPAC: 5,7-dihydroxy-3-(4-hydroxyphenyl)chromen-4-one SMILES: OC1=CC=C(C=C1)C1=COC2=CC(O)=CC(O)=C2C1=O