Phenylpropanoids and polyketides

Flavanone, 98+%

CAS: 487-26-3 Molecular Formula: C15H12O2 Molecular Weight (g/mol): 224.26 MDL Number: MFCD00006841 InChI Key: ZONYXWQDUYMKFB-UHFFFAOYNA-N Synonym: flavanone,2-phenylchroman-4-one,2,3-dihydroflavone,2-phenyl-4-chromanone,4-flavanone,2,3-dihydro-2-phenyl-4h-1-benzopyran-4-one,4h-1-benzopyran-4-one, 2,3-dihydro-2-phenyl,2-phenyl-2,3-dihydro-4h-chromen-4-one,2,3-dihydro-2-phenyl-4h-benzopyran-4-one,2-phenyl-3,4-dihydro-2h-1-benzopyran-4-one PubChem CID: 10251 ChEBI: CHEBI:5070 IUPAC Name: 2-phenyl-2,3-dihydrochromen-4-one SMILES: O=C1CC(OC2=CC=CC=C12)C1=CC=CC=C1

3',5,7-Trihydroxy-4'-methoxyflavanone, 97%

CAS: 520-33-2 Molecular Formula: C16H14O6 Molecular Weight (g/mol): 302.28 MDL Number: MFCD00075646 InChI Key: AIONOLUJZLIMTK-AWEZNQCLSA-N Synonym: 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 IUPAC Name: (2S)-5,7-dihydroxy-2-(3-hydroxy-4-methoxyphenyl)-2,3-dihydrochromen-4-one SMILES: COC1=CC=C(C=C1O)[C@@H]1CC(=O)C2=C(O)C=C(O)C=C2O1

5-Hydroxyflavone, 97%

CAS: 491-78-1 Molecular Formula: C15H10O3 Molecular Weight (g/mol): 238.24 MDL Number: MFCD00016944 InChI Key: IYBLVRRCNVHZQJ-UHFFFAOYSA-N Synonym: 5-hydroxyflavone,primuletin,5-hydroxy-2-phenyl-4h-chromen-4-one,5-hydroxy-2-phenyl-chromen-4-one,chembl16807,4h-1-benzopyran-4-one,5-hydroxy-2-phenyl,primuliten,5-hydroxy-flavone,5-hydroxy-2-phenyl-4-benzopyrone,5-hydroxy-2-phenyl-4h-chromen-4-on PubChem CID: 68112 IUPAC Name: 5-hydroxy-2-phenylchromen-4-one SMILES: OC1=C2C(=O)C=C(OC2=CC=C1)C1=CC=CC=C1

4',5,7-Trihydroxyflavanone, 97%

CAS: 67604-48-2 Molecular Formula: C15H12O5 Molecular Weight (g/mol): 272.256 MDL Number: MFCD00006844 InChI Key: FTVWIRXFELQLPI-UHFFFAOYSA-N Synonym: naringenin,5,7-dihydroxy-2-4-hydroxyphenyl chroman-4-one,naringenine,4',5,7-trihydroxyflavanone,+/--naringenin,naringetol,salipurpol,--naringenin,narigenin,salipurol PubChem CID: 932 ChEBI: CHEBI:50202 IUPAC Name: 5,7-dihydroxy-2-(4-hydroxyphenyl)-2,3-dihydrochromen-4-one SMILES: C1C(OC2=CC(=CC(=C2C1=O)O)O)C3=CC=C(C=C3)O

alpha-Bromocinnamaldehyde, 98%

CAS: 5443-49-2 Molecular Formula: C9H7BrO Molecular Weight (g/mol): 211.058 MDL Number: MFCD00006965 InChI Key: WQRWNOKNRHCLHV-TWGQIWQCSA-N Synonym: 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 PubChem CID: 5369403 IUPAC Name: (Z)-2-bromo-3-phenylprop-2-enal SMILES: C1=CC=C(C=C1)C=C(C=O)Br

Rottlerin, 95+%

CAS: 82-08-6 Molecular Formula: C₃₀H₂₈O₈ Molecular Weight (g/mol): 516.6 MDL Number: MFCD00017361 InChI Key: DEZFNHCVIZBHBI-ZHACJKMWSA-N Synonym: rottlerin,mallotoxin,kamalin,unii-e29lp3zmuh,e29lp3zmuh,chembl34241,bmk1-f10,e-1-6-3-acetyl-2,4,6-trihydroxy-5-methylphenyl methyl-5,7-dihydroxy-2,2-dimethyl-2h-1-benzopyran-8-yl-3-phenyl-2-propen-1-one,1-6-3-acetyl-2,4,6-trihydroxy-5-methyl-benzyl-5,7-dihydroxy-2,2-dimethyl-2h-chromen-8-yl-3-phenyl-propenone,1-6-3-acetyl-2,4,6-trihydroxy-5-methylphenyl methyl-5,7-dihydroxy-2,2-dimethyl-2h-1-benzopyran-8-yl-3-phenyl-2-propen-1-one PubChem CID: 5281847 ChEBI: CHEBI:8899 IUPAC Name: (E)-1-[6-[(3-acetyl-2,4,6-trihydroxy-5-methylphenyl)methyl]-5,7-dihydroxy-2,2-dimethylchromen-8-yl]-3-phenylprop-2-en-1-one SMILES: CC1=C(C(=C(C(=C1O)C(=O)C)O)CC2=C(C3=C(C(=C2O)C(=O)C=CC4=CC=CC=C4)OC(C=C3)(C)C)O)O

4,4'-Diaminostilbene-2,2'-disulfonic acid, 95%

CAS: 81-11-8 Molecular Formula: C₁₄H₁₄N₂O₆S₂ Molecular Weight (g/mol): 370.4 MDL Number: MFCD00024946 InChI Key: REJHVSOVQBJEBF-OWOJBTEDSA-N Synonym: amsonic acid,flavonic acid,tinopal bhs,amsonsaeure,dasd,4,4'-diaminostilbene-2,2'-disulfonic acid,unii-h68088wvjl,2,2'-disulfo-4,4'-stilbenediamine,diaminostilbenedisulfonic acid,4,4'-diaminostilbene-2,2'-disulphonic acid PubChem CID: 5284378 IUPAC Name: 5-amino-2-[(E)-2-(4-amino-2-sulfophenyl)ethenyl]benzenesulfonic acid SMILES: C1=CC(=C(C=C1N)S(=O)(=O)O)C=CC2=C(C=C(C=C2)N)S(=O)(=O)O

3,3'-Carbonylbis(7-diethylaminocoumarin), 99%

CAS: 63226-13-1 Molecular Formula: C₂₇H₂₈N₂O₅ Molecular Weight (g/mol): 460.52 MDL Number: MFCD00050047 InChI Key: SANIRTQDABNCHF-UHFFFAOYSA-N Synonym: 3,3'-carbonylbis 7-diethylaminocoumarin,3,3'-carbonylbis 7-diethylamino-2h-chromen-2-one,2h-1-benzopyran-2-one, 3,3'-carbonylbis 7-diethylamino,7-diethylamino-3-7-diethylamino-2-oxochromene-3-carbonyl chromen-2-one,7-diethylamino-3-7-diethylamino-2-oxochromen-3-yl carbonyl chromen-2-one,3,3'-carbonyl-bis-7-diethylaminocoumarin,2h-1-benzopyran-2-one, 3,3-carbonylbis 7-diethylamino,7-diethylamino-3-7-diethylamino-2-oxo-2h-chromen-3-yl carbonyl-2h-ch romen-2-one PubChem CID: 113160 IUPAC Name: 7-(diethylamino)-3-[7-(diethylamino)-2-oxochromene-3-carbonyl]chromen-2-one SMILES: CCN(CC)C1=CC2=C(C=C1)C=C(C(=O)O2)C(=O)C3=CC4=C(C=C(C=C4)N(CC)CC)OC3=O

4-Hydroxyphenyl benzoate, 98%

CAS: 2444-19-1 Molecular Formula: C13H10O3 Molecular Weight (g/mol): 214.22 MDL Number: MFCD00053304 InChI Key: JFAXJRJMFOACBO-UHFFFAOYSA-N Synonym: hydroquinone monobenzoate,p-hydroxyphenyl benzoate,unii-zcy7o225cp,4-benzoyloxyphenol,1,4-diphenol, 1-benzoate,benzoic acid 4-hydroxyphenyl ester,4-hydroxyphenyl benzoate,zcy7o225cp,4-hydroxyphenylbenzoate,4-hydroxyphenylbenzoat PubChem CID: 75549 IUPAC Name: (4-hydroxyphenyl) benzoate SMILES: OC1=CC=C(OC(=O)C2=CC=CC=C2)C=C1

Rifabutin, 98%, Thermo Scientific Chemicals

CAS: 72559-06-9 Molecular Formula: C46H62N4O11 Molecular Weight (g/mol): 847.02 MDL Number: MFCD00866816 InChI Key: ATEBXHFBFRCZMA-VXTBVIBXSA-N Synonym: rifabutin,ansamycin,rifabutine,mycobutin,ansatipine,ansatipin,alfacid,rifabutina,rifabutinum,antibiotic lm 427 PubChem CID: 57448257 IUPAC Name: (7S,9E,11S,12R,13S,14R,15R,16R,17S,18S,19E,21Z)-2,15,17-trihydroxy-11-methoxy-3,7,12,14,16,18,22-heptamethyl-1'-(2-methylpropyl)-6,23,32-trioxo-8,33-dioxa-24,27,29-triazaspiro[pentacyclo[23.6.1.1⁴,⁷.0⁵,³¹.0²⁶,³⁰]tritriacontane-28,4'-piperidin]-1,3,5(31),9,19,21,25,29-octaen-13-yl acetate SMILES: CO[C@H]1\C=C\O[C@@]2(C)OC3=C(C)C(O)=C4C(=O)C(NC(=O)\C(C)=C/C=C/[C@H](C)[C@H](O)[C@@H](C)[C@@H](O)[C@@H](C)[C@H](OC(C)=O)[C@@H]1C)=C1NC5(CCN(CC(C)C)CC5)N=C1C4=C3C2=O

4-(5-bromothien-2-yl)pyridine, 97%, Thermo Scientific™

CAS: 2199-93-1 Molecular Formula: C11H7BrO3 Molecular Weight (g/mol): 267.08 MDL Number: MFCD00024075 InChI Key: XFQYOFLFNKCHLG-UHFFFAOYSA-N Synonym: 3-acetyl-6-bromocoumarin,3-acetyl-6-bromo-2h-chromen-2-one,3-acetyl-6-bromo-chromen-2-one,2h-1-benzopyran-2-one,3-acetyl-6-bromo,3-acetyl-6-bromo-2-oxochromene,pubchem13336,maybridge1_000212,zerenex e/1034014,6-bromanyl-3-ethanoyl-chromen-2-one PubChem CID: 304813 IUPAC Name: 3-acetyl-6-bromochromen-2-one SMILES: CC(=O)C1=CC2=CC(Br)=CC=C2OC1=O

Pentafluorophenyl 3-(pyrid-2-yloxy)benzoate, 97%, Thermo Scientific™

CAS: 921938-61-6 Molecular Formula: C18H8F5NO3 Molecular Weight (g/mol): 381.258 MDL Number: MFCD09064956 InChI Key: LKCOLTBNDUOLEF-UHFFFAOYSA-N Synonym: pentafluorophenyl 3-pyrid-2-yloxy benzoate,pentafluorophenyl 3-pyridin-2-yloxy benzoate,pentafluorophenyl 3-pyridin-2-yl oxy benzoate,2,3,4,5,6-pentafluorophenyl 3-pyridin-2-yloxy benzoate,2,3,4,5,6-pentakis fluoranyl phenyl 3-pyridin-2-yloxybenzoate,3-2-pyridinyloxy benzoic acid 2,3,4,5,6-pentafluorophenyl ester PubChem CID: 24229506 IUPAC Name: (2,3,4,5,6-pentafluorophenyl) 3-pyridin-2-yloxybenzoate SMILES: C1=CC=NC(=C1)OC2=CC=CC(=C2)C(=O)OC3=C(C(=C(C(=C3F)F)F)F)F

Pentafluorophenyl 4-(1,3-oxazol-5-yl)benzoate, 97%, Thermo Scientific™

3-(2-Chloro-3,4-dimethoxyphenyl)acrylic acid, 97%, Thermo Scientific™

CAS: 99854-17-8 Molecular Formula: C11H10ClO4 Molecular Weight (g/mol): 241.65 MDL Number: MFCD00084947 InChI Key: JIPTVEJKXDVECY-GQCTYLIASA-M Synonym: 3-2-chloro-3,4-dimethoxyphenyl acrylic acid,2-chloro-3,4-dimethoxycinnamic acid,2e-3-2-chloro-3,4-dimethoxyphenyl prop-2-enoic acid,e-3-2-chloro-3,4-dimethoxyphenyl acrylic acid,e-3-2-chloro-3,4-dimethoxy-phenyl-acrylic acid,e-3-2-chloro-3,4-dimethoxyphenyl prop-2-enoic acid,2e-3-2-chloro-3,4-dimethoxyphenyl-2-propenoic acid PubChem CID: 5708524 IUPAC Name: (E)-3-(2-chloro-3,4-dimethoxyphenyl)prop-2-enoic acid SMILES: COC1=CC=C(\C=C\C([O-])=O)C(Cl)=C1OC

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