Phenylpropanoids and polyketides
(R)-(-)-2-Phenylpropionic acid, 99%
CAS: 7782-26-5 Formule moléculaire: C9H10O2 Poids moléculaire (g/mol): 150.18 Numéro MDL: MFCD00063140 Clé InChI: YPGCWEMNNLXISK-SSDOTTSWSA-N Synonyme: r---2-phenylpropionic acid,r-2-phenylpropanoic acid,2r-2-phenylpropanoic acid,r-hydratropic acid,--hydratropic acid,r---hydratropic acid,r---2-phenylpropionicacid,r-2-phenylpropionic acid,r-2-phenyl-propionic acid,r-2-phenyl-proprionic acid CID PubChem: 446626 ChEBI: CHEBI:43035 Nom IUPAC: (2R)-2-phenylpropanoic acid SMILES: CC(C1=CC=CC=C1)C(=O)O
3-(3,4-Dimethoxyphenyl)propionic acid, 98%
CAS: 2107-70-2 Formule moléculaire: C11H14O4 Poids moléculaire (g/mol): 210.229 Numéro MDL: MFCD00002774 Clé InChI: LHHKQWQTBCTDQM-UHFFFAOYSA-N Synonyme: 3-3,4-dimethoxyphenyl propionic acid,3-3,4-dimethoxyphenyl propanoic acid,3,4-dimethoxyhydrocinnamic acid,benzenepropanoic acid, 3,4-dimethoxy,3-3,4-dimethoxyphenyl-propionic acid,3-3,4-dimethoxy-phenyl-propionic acid,unii-6xo32zsp1d,6xo32zsp1d,3-3',4'-dimethoxyphenyl propanoic acid,3-3,4-dimethoxyphenyl propionicacid CID PubChem: 75019 ChEBI: CHEBI:44235 Nom IUPAC: 3-(3,4-dimethoxyphenyl)propanoic acid SMILES: COC1=C(C=C(C=C1)CCC(=O)O)OC
4',5-Dihydroxy-7-methoxyflavone, 97%
CAS: 437-64-9 Formule moléculaire: C16H12O5 Poids moléculaire (g/mol): 284.267 Numéro MDL: MFCD00017452 Clé InChI: JPMYFOBNRRGFNO-UHFFFAOYSA-N Synonyme: genkwanin,gengkwanin,4',5-dihydroxy-7-methoxyflavone,5,4'-dihydroxy-7-methoxyflavone,7-o-methylapigenin,7-methylapigenin,apigenin 7-methyl ether,puddumetin,gonkwanin,unii-5k3i5d6b2b CID PubChem: 5281617 ChEBI: CHEBI:75718 Nom IUPAC: 5-hydroxy-2-(4-hydroxyphenyl)-7-methoxychromen-4-one SMILES: COC1=CC(=C2C(=C1)OC(=CC2=O)C3=CC=C(C=C3)O)O
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
Thermo Scientific Chemicals Fisetin
CAS: 528-48-3 Formule moléculaire: C15H10O6 Poids moléculaire (g/mol): 286.24 Clé InChI: XHEFDIBZLJXQHF-UHFFFAOYSA-N Nom IUPAC: 2-(3,4-dihydroxyphenyl)-3,7-dihydroxy-4H-chromen-4-one SMILES: OC1=CC=C2C(OC(=C(O)C2=O)C2=CC=C(O)C(O)=C2)=C1
(+/-)-2-Phenylpropionic acid, 98%
CAS: 492-37-5 Formule moléculaire: C9H10O2 Poids moléculaire (g/mol): 150.177 Numéro MDL: MFCD00002650 Clé InChI: YPGCWEMNNLXISK-UHFFFAOYSA-N Synonyme: 2-phenylpropionic acid,hydratropic acid,dl-2-phenylpropionic acid,alpha-methylphenylacetic acid,2-phenyl-propionic acid,+/--2-phenylpropionic acid,alpha-methylbenzeneacetic acid,benzeneacetic acid, .alpha.-methyl,hydratropasaeure,alpha-phenylpropionic acid CID PubChem: 10296 ChEBI: CHEBI:48526 Nom IUPAC: 2-phenylpropanoic acid SMILES: CC(C1=CC=CC=C1)C(=O)O
Camostat methanesulfate, 98%
CAS: 59721-29-8 Formule moléculaire: C21H26N4O8S Poids moléculaire (g/mol): 494.52 Numéro MDL: MFCD00941410 Clé InChI: FSEKIHNIDBATFG-UHFFFAOYSA-N Synonyme: camostat mesylate,camostat mesilate,camostat methanesulfonate,camostat monomethanesulfonate,foipan,unii-451m50a1eq,dsstox_cid_238,dsstox_rid_75452,dsstox_gsid_20238 CID PubChem: 5284360 Nom IUPAC: 4-{2-[(dimethylcarbamoyl)methoxy]-2-oxoethyl}phenyl 4-[(diaminomethylidene)amino]benzoate; methanesulfonic acid SMILES: CS(O)(=O)=O.CN(C)C(=O)COC(=O)CC1=CC=C(OC(=O)C2=CC=C(C=C2)N=C(N)N)C=C1
trans-Chalcone, 97%
CAS: 614-47-1 Formule moléculaire: C15H12O Poids moléculaire (g/mol): 208.26 Numéro MDL: MFCD00003082 Clé InChI: DQFBYFPFKXHELB-VAWYXSNFSA-N Synonyme: chalcone,trans-chalcone,e-chalcone,benzalacetophenone,chalkone,benzylideneacetophenone,phenyl styryl ketone,cinnamophenone,2-benzalacetophenone,2-benzylideneacetophenone CID PubChem: 637760 ChEBI: CHEBI:48965 Nom IUPAC: (E)-1,3-diphenylprop-2-en-1-one SMILES: C1=CC=C(C=C1)C=CC(=O)C2=CC=CC=C2
4-Fluorocinnamic acid, 99%
CAS: 459-32-5 Formule moléculaire: C9H7FO2 Poids moléculaire (g/mol): 166.15 Numéro MDL: MFCD00004395 Clé InChI: ISMMYAZSUSYVQG-ZZXKWVIFSA-N Synonyme: 4-fluorocinnamic acid,e-3-4-fluorophenyl acrylic acid,2e-3-4-fluorophenyl prop-2-enoic acid,p-fluorocinnamic acid,3-4-fluorophenyl acrylic acid,e-p-fluorocinnamic acid,trans-4-fluorocinnamic acid,p-fluoro cinnamic acid,3-4-fluorophenyl prop-2-enoic acid,2-propenoic acid, 3-4-fluorophenyl-, 2e CID PubChem: 1530234 Nom IUPAC: (E)-3-(4-fluorophenyl)prop-2-enoic acid SMILES: C1=CC(=CC=C1C=CC(=O)O)F
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
3,3',4',7-Tetrahydroxyflavone, 96%
CAS: 528-48-3 Formule moléculaire: C15H10O6 Poids moléculaire (g/mol): 286.239 Numéro MDL: MFCD00006829 Clé InChI: XHEFDIBZLJXQHF-UHFFFAOYSA-N Synonyme: fisetin,viset,5-desoxyquercetin,fustel,2-3,4-dihydroxyphenyl-3,7-dihydroxy-4h-chromen-4-one,fisetholz,superfustel,cotinin,fietin,fustet CID PubChem: 5281614 ChEBI: CHEBI:42567 Nom IUPAC: 2-(3,4-dihydroxyphenyl)-3,7-dihydroxychromen-4-one SMILES: C1=CC(=C(C=C1C2=C(C(=O)C3=C(O2)C=C(C=C3)O)O)O)O
trans-4-Hydroxy-3-methoxycinnamic acid, 99%
CAS: 537-98-4 Formule moléculaire: C10H10O4 Poids moléculaire (g/mol): 194.19 Numéro MDL: MFCD00004400 Clé InChI: KSEBMYQBYZTDHS-HWKANZROSA-N Synonyme: 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 CID PubChem: 445858 ChEBI: CHEBI:17620 Nom IUPAC: (E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoic acid SMILES: COC1=CC(\C=C\C(O)=O)=CC=C1O
Phenyl benzoate, 99%
CAS: 93-99-2 Formule moléculaire: C13H10O2 Poids moléculaire (g/mol): 198.22 Numéro MDL: MFCD00003072 Clé InChI: FCJSHPDYVMKCHI-UHFFFAOYSA-N Synonyme: 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 CID PubChem: 7169 ChEBI: CHEBI:86919 Nom IUPAC: phenyl benzoate SMILES: C1=CC=C(C=C1)C(=O)OC2=CC=CC=C2
Dicumarol, 99%
CAS: 66-76-2 Formule moléculaire: C19H12O6 Poids moléculaire (g/mol): 336.30 Numéro MDL: MFCD00006857 Clé InChI: DOBMPNYZJYQDGZ-UHFFFAOYSA-N Synonyme: dicumarol,dicoumarol,bishydroxycoumarin,dicoumarin,melitoxin,antitrombosin,baracoumin,dicoumal,dicumarine,acadyl CID PubChem: 54676038 ChEBI: CHEBI:4513 Nom IUPAC: 4-hydroxy-3-[(4-hydroxy-2-oxochromen-3-yl)methyl]chromen-2-one SMILES: OC1=C(CC2=C(O)C3=CC=CC=C3OC2=O)C(=O)OC2=CC=CC=C12
Rutin, 97+%
CAS: 207671-50-9 Formule moléculaire: C27H30O16 Poids moléculaire (g/mol): 610.52 Numéro MDL: MFCD01319140 Clé InChI: IKGXIBQEEMLURG-NVPNHPEKSA-N Synonyme: rutin,rutoside,phytomelin,quercetin 3-rutinoside,birutan,eldrin,myrticolorin,venoruton,3-rutinosyl quercetin,bioflavonoid CID PubChem: 5280805 ChEBI: CHEBI:28527 Nom IUPAC: 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