Phenylpropanoids and polyketides
Ascomycin, 95%
CAS: 104987-12-4 Molecular Formula: C43H69NO12 Molecular Weight (g/mol): 792.02 MDL Number: MFCD06198665 InChI Key: ZDQSOHOQTUFQEM-NURRSENYSA-N Synonym: ascomycin,immunomycin,unii-auf4u5nsjk,ascomycin fk520,auf4u5nsjk,chembl8597,15,19-epoxy-3h-pyrido 2,1-c 1,4 oxaazacyclotricosine-1,7,20,21 4h,23h-tetrone, 8-ethyl-5,6,8,11,12,13,14,15,16,17,18,19,24,25,26,26a-hexadecahydro-5,19-dihydroxy-3-2-4-hydroxy-3-methoxycyclohexyl-1-methylethenyl-14,16-dimethoxy-4,10,12,18-tetram,ascomycin from streptomyces hygroscopicus var. ascomyceticus,15,19-epoxy-3h-pyrido 2,1-c 1,4 oxaazacyclotricosine-1,7,20,21 4h,23h-tetrone, 5,6,8,11,12,13,14,15,16,17,18,19,24,25,26,26a-hexadecahydro-5,19-dihydroxy-8-ethyl-3-2-4-hydroxy-3-methoxycyclohexyl-1-methylethenyl-14,16-dimethoxy-4,10,12,18-tetramethyl-, 3s-3r* e 1s*,3s*,4s* ,4s*,19s*,26ar*,ascomycin fk 520, fr 900520, imm PubChem CID: 5282071 ChEBI: CHEBI:29582 SMILES: CCC1C=C(CC(CC(C2C(CC(C(O2)(C(=O)C(=O)N3CCCCC3C(=O)OC(C(C(CC1=O)O)C)C(=CC4CCC(C(C4)OC)O)C)O)C)OC)OC)C)C
Ochratoxin A, 99+%
CAS: 303-47-9 Molecular Formula: C20H18ClNO6 Molecular Weight (g/mol): 403.82 MDL Number: MFCD00078079 InChI Key: RWQKHEORZBHNRI-BMIGLBTASA-N Synonym: ochratoxin a,antibiotic 9663,phenylalanine-ochratoxin a,3r14s-ochratoxin a,ochratoxin a-bsa conjugate from aspergillus ochraceus,--n-5-chloro-8-hydroxy-3-methyl-1-oxo-7-isochromanyl carbonyl-3-phenylalanine,n-3r-5-chloro-8-hydroxy-3-methyl-1-oxo-7-isochromanyl carbonyl-3-phenyl-l-alanine,unii-1779sx6luy,l-phenylalanine, n-5-chloro-3,4-dihydro-8-hydroxy-3-methyl-1-oxo-1h-2-benzopyran-7-yl carbonyl-, r,ccris 2382 PubChem CID: 442530 ChEBI: CHEBI:7719 IUPAC Name: (2S)-2-[[(3R)-5-chloro-8-hydroxy-3-methyl-1-oxo-3,4-dihydroisochromene-7-carbonyl]amino]-3-phenylpropanoic acid SMILES: CC1CC2=C(C=C(C(=C2C(=O)O1)O)C(=O)NC(CC3=CC=CC=C3)C(=O)O)Cl
3,4-(Methylenedioxy)cinnamic acid, predominantly trans, 99%
CAS: 2373-80-0 Molecular Formula: C10H8O4 Molecular Weight (g/mol): 192.17 MDL Number: MFCD00005837 InChI Key: QFQYZMGOKIROEC-DUXPYHPUSA-N Synonym: 3,4-methylenedioxycinnamic acid,3,4-methylenedioxy cinnamic acid,3-benzo d 1,3 dioxol-5-yl acrylic acid,unii-x8h0wpj08y,3-1,3-benzodioxol-5-yl acrylic acid,2e-3-2h-1,3-benzodioxol-5-yl prop-2-enoic acid,methylenedioxycinnamic acid,x8h0wpj08y,2e-3-1,3-benzodioxol-5-yl acrylic acid,2e-3-1,3-benzodioxol-5-yl-2-propenoic acid PubChem CID: 643181 ChEBI: CHEBI:81482 IUPAC Name: (E)-3-(1,3-benzodioxol-5-yl)prop-2-enoic acid SMILES: C1OC2=C(O1)C=C(C=C2)C=CC(=O)O
4-Ethoxycinnamic acid, prediminantly trans, 98+%
CAS: 2373-79-7 Molecular Formula: C11H12O3 Molecular Weight (g/mol): 192.214 MDL Number: MFCD00016848 InChI Key: DZLOUWYGNATKKZ-VMPITWQZSA-N Synonym: 4-ethoxycinnamic acid,3-4-ethoxyphenyl acrylic acid,2e-3-4-ethoxyphenyl acrylic acid,2e-3-4-ethoxyphenyl prop-2-enoic acid,e-3-4-ethoxyphenyl acrylic acid,e-3-4-ethoxyphenyl prop-2-enoic acid,4-ethoxyphenylacrylic acid,p-ethoxycinnamic acid,ethoxyphenylacrylicacid,pubchem8239 PubChem CID: 704218 IUPAC Name: (E)-3-(4-ethoxyphenyl)prop-2-enoic acid SMILES: CCOC1=CC=C(C=C1)C=CC(=O)O
2,3-Dimethoxycinnamic acid, predominantly trans, 98+%
CAS: 7345-82-6 Molecular Formula: C11H12O4 Molecular Weight (g/mol): 208.213 MDL Number: MFCD00004376 InChI Key: QAXPUWGAGVERSJ-VOTSOKGWSA-N Synonym: 2,3-dimethoxycinnamic acid,trans-2,3-dimethoxycinnamic acid,2e-3-2,3-dimethoxyphenyl acrylic acid,e-3-2,3-dimethoxyphenyl acrylic acid,2,3-dimethoxy cinnamic acid,3-2,3-dimethoxyphenyl acrylic acid,2e-3-2,3-dimethoxyphenyl prop-2-enoic acid,2-propenoic acid, 3-2,3-dimethoxyphenyl,e-3-2,3-dimethoxyphenyl prop-2-enoic acid,e-3-2,3-dimethoxy-phenyl-acrylic acid PubChem CID: 735842 IUPAC Name: (E)-3-(2,3-dimethoxyphenyl)prop-2-enoic acid SMILES: COC1=CC=CC(=C1OC)C=CC(=O)O
Thermo Scientific Chemicals Curcumin (mixture of curcumin, demethoxycurcumin, and bisdemethoxycurcumin), 96%
CAS: 458-37-7 Molecular Formula: C21H20O6 Molecular Weight (g/mol): 368.39 MDL Number: MFCD00008365 InChI Key: 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 SMILES: COC1=CC(\C=C\C(\O)=C\C(=O)\C=C\C2=CC=C(O)C(OC)=C2)=CC=C1O
4-Methoxycinnamic acid, 99%
CAS: 830-09-1 Molecular Formula: C10H10O3 Molecular Weight (g/mol): 178.187 MDL Number: MFCD00004398 InChI Key: AFDXODALSZRGIH-QPJJXVBHSA-N Synonym: 4-methoxycinnamic acid,p-methoxycinnamic acid,3-4-methoxyphenyl acrylic acid,trans-4-methoxycinnamic acid,4-methoxycinnamate,para-methoxycinnamic acid,o-methyl-p-coumaric acid,cinnamic acid, p-methoxy,e-3-4-methoxyphenyl acrylic acid,e-3-4-methoxyphenyl-2-propenoic acid PubChem CID: 699414 IUPAC Name: (E)-3-(4-methoxyphenyl)prop-2-enoic acid SMILES: COC1=CC=C(C=C1)C=CC(=O)O
alpha-Cyano-4-hydroxycinnamic acid, Ultrapure MALDI Matrix, Thermo Scientific Chemicals
CAS: 28166-41-8 Molecular Formula: C10H7NO3 Molecular Weight (g/mol): 189.17 MDL Number: MFCD00004204 InChI Key: AFVLVVWMAFSXCK-YVMONPNESA-N Synonym: alpha-cyano-4-hydroxycinnamate,2-cyano-4-hydroxycinnamate,2-cyano-3-4-hydroxyphe-nyl acrylic acid,2z-2-cyano-3-4-hydroxyphenyl prop-2-enoic acid PubChem CID: 9794103 IUPAC Name: (Z)-2-cyano-3-(4-hydroxyphenyl)prop-2-enoic acid SMILES: C1=CC(=CC=C1C=C(C#N)C(=O)O)O
trans-2-Methoxycinnamic acid, 98+%
CAS: 1011-54-7 Molecular Formula: C10H10O3 Molecular Weight (g/mol): 178.187 MDL Number: MFCD00064238 InChI Key: FEGVSPGUHMGGBO-VOTSOKGWSA-N Synonym: 2-methoxycinnamic acid,trans-2-methoxycinnamic acid,3-2-methoxyphenyl acrylic acid,2e-3-2-methoxyphenyl acrylic acid,2e-3-2-methoxyphenyl prop-2-enoic acid,o-methoxycinnamic acid,e-3-2-methoxyphenyl acrylic acid,e-3-2-methoxyphenyl-2-propenoic acid,e-o-methoxycinnamic acid,trans-o-methyl-o-coumaric acid PubChem CID: 734154 IUPAC Name: (E)-3-(2-methoxyphenyl)prop-2-enoic acid SMILES: COC1=CC=CC=C1C=CC(=O)O
2-Fluorocinnamic acid, predominantly trans, 98%
CAS: 451-69-4 Molecular Formula: C9H7FO2 Molecular Weight (g/mol): 166.15 MDL Number: MFCD00004370 InChI Key: IOUDZAFBPDDAMK-AATRIKPKSA-N Synonym: 2-fluorocinnamic acid,o-fluorocinnamic acid,cinnamic acid, o-fluoro,2-propenoic acid, 3-2-fluorophenyl,2e-3-2-fluorophenyl prop-2-enoic acid,3-2-fluorophenyl acrylic acid,3-2-fluoro-phenyl-acrylic acid,2e-3-2-fluorophenyl acrylic acid,3-2-fluorophenyl-2-propenoic acid,trans-2-fluorocinnamic acid PubChem CID: 735833 IUPAC Name: (E)-3-(2-fluorophenyl)prop-2-enoic acid SMILES: OC(=O)\C=C\C1=CC=CC=C1F
3-(1-Naphthyl)acrylic acid, 98%
CAS: 13026-12-5 Molecular Formula: C13H10O2 Molecular Weight (g/mol): 198.22 MDL Number: MFCD00014317,MFCD00014317 InChI Key: WPXMLUUYWNHQOR-CMDGGOBGSA-N Synonym: naphthalene-1-acrylic acid,z-3-1-naphthyl acrylic acid,z-3-naphthalen-1-yl-acrylic acid,z-3-naphthalen-1-yl acrylic acid,2z-3-naphthalen-1-yl prop-2-enoic acid PubChem CID: 12158295 SMILES: OC(=O)\C=C\C1=C2C=CC=CC2=CC=C1
4-Hydroxybenzylideneacetone, 97%
CAS: 3160-35-8 Molecular Formula: C10H10O2 Molecular Weight (g/mol): 162.19 MDL Number: MFCD00016490 InChI Key: OCNIKEFATSKIBE-NSCUHMNNSA-N Synonym: p-hydroxybenzalacetone,4-hydroxybenzylideneacetone,4-hydroxybenzal acetone,4-hydroxycinnamoylmethane,4-hydroxybenzalacetone,p-hydroxybenzylidene acetone,4-p-hydroxyphenyl-3-buten-2-one,4-4-hydroxyphenyl but-3-en-2-one,3-buten-2-one, 4-4-hydroxyphenyl,3-buten-2-one, 4-p-hydroxyphenyl PubChem CID: 796857 SMILES: CC(=O)\C=C\C1=CC=C(O)C=C1
trans-4-Hydroxycinnamic acid, 98%
CAS: 501-98-4 Molecular Formula: C9H8O3 Molecular Weight (g/mol): 164.16 MDL Number: MFCD00004399 InChI Key: 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 Name: (E)-3-(4-hydroxyphenyl)prop-2-enoic acid SMILES: C1=CC(=CC=C1C=CC(=O)O)O
4-Hydroxy-3-methoxycinnamic acid, Mixture of isomers, ≥99.0% (HPLC), MilliporeSigma™ Supelco™
4-Hydroxy-3-methoxycinnamic acid is a ubiquitous plant constituent primarily occurring in seeds and leaves. It arises from the metabolism of phenylalanine and tyrosine.
3,5-Di-tert-butyl-4-hydroxycinnamic acid, predominantly trans, 97%
CAS: 22014-01-3 Molecular Formula: C17H24O3 Molecular Weight (g/mol): 276.38 MDL Number: MFCD00017291 InChI Key: CTYWXRDQWMRIIM-BQYQJAHWSA-N Synonym: 3-3,5-di-tert-butyl-4-hydroxyphenyl acrylic acid,unii-k7zj1m9j5t,k7zj1m9j5t,3,5-di-tert-butyl-4-hydroxycinnamic acid,3,5-di-t-butyl-4-hydroxycinnamic acid,3,5-di-tert-butyl-4-hydroxycinnamic acid, predominantly trans,2e-3-3,5-di-tert-butyl-4-hydroxyphenyl prop-2-enoic acid,3-3,5-di-tert-butyl-4-hydroxyphenyl prop-2-enoic acid,2e-3-3,5-bis tert-butyl-4-hydroxyphenyl prop-2-enoic acid,2e-3-3,5-ditert-butyl-4-hydroxyphenyl acrylic acid PubChem CID: 689095 IUPAC Name: (E)-3-(3,5-ditert-butyl-4-hydroxyphenyl)prop-2-enoic acid SMILES: CC(C)(C)C1=CC(\C=C\C(O)=O)=CC(=C1O)C(C)(C)C