Phenylpropanoids and polyketides

TissuePrep™ Embedding Media (Certified), Fisher Chemical

CAS: 8002-74-2 Molecular Formula: C21H27NO3 Molecular Weight (g/mol): 341.451 MDL Number: MFCD00212755 InChI Key: JWHAUXFOSRPERK-UHFFFAOYSA-N Synonym: gnf-pf-4594 PubChem CID: 4932 ChEBI: CHEBI:63619 IUPAC Name: 1-[2-[2-hydroxy-3-(propylamino)propoxy]phenyl]-3-phenylpropan-1-one SMILES: CCCNCC(COC1=CC=CC=C1C(=O)CCC2=CC=CC=C2)O

Paraffin Oil Light, MilliporeSigma™

CAS: 8012-95-1 Molecular Formula: C15H11ClO7 Molecular Weight (g/mol): 338.696 InChI Key: FFNDMZIBVDSQFI-UHFFFAOYSA-N Synonym: 3,5,7-trihydroxy-2-3,4,5-trihydroxyphenyl benzopyrylium chloride PubChem CID: 68245 ChEBI: CHEBI:38701 IUPAC Name: 2-(3,4,5-trihydroxyphenyl)chromenylium-3,5,7-triol;chloride SMILES: C1=C(C=C(C(=C1O)O)O)C2=C(C=C3C(=CC(=CC3=[O+]2)O)O)O.[Cl-]

Ibuprofen, USP grade, MP Biomedicals™

CAS: 15687-27-1 Molecular Formula: C13H18O2 Molecular Weight (g/mol): 206.285 MDL Number: MFCD00010393 InChI Key: HEFNNWSXXWATRW-UHFFFAOYSA-N Synonym: 2-4-isobutylphenyl propanoic acid PubChem CID: 3672 ChEBI: CHEBI:5855 IUPAC Name: 2-[4-(2-methylpropyl)phenyl]propanoic acid SMILES: CC(C)CC1=CC=C(C=C1)C(C)C(=O)O

Alfa Aesar™ alpha-Cyano-4-hydroxycinnamic acid, Ultrapure MALDI Matrix

CAS: 28166-41-8 Molecular Formula: C10H7NO3 Molecular Weight (g/mol): 189.17 MDL Number: MFCD00004204 InChI Key: AFVLVVWMAFSXCK-YVMONPNESA-N Synonym: 2-cyano-3-4-hydroxyphe-nyl acrylic 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

Alfa Aesar™ 4-Isobutyl-alpha-methylphenylacetic acid, 99%

CAS: 15687-27-1 Molecular Formula: C13H18O2 Molecular Weight (g/mol): 206.285 MDL Number: MFCD00010393 InChI Key: HEFNNWSXXWATRW-UHFFFAOYSA-N Synonym: 2-4-isobutylphenyl propanoic acid PubChem CID: 3672 ChEBI: CHEBI:5855 IUPAC Name: 2-[4-(2-methylpropyl)phenyl]propanoic acid SMILES: CC(C)CC1=CC=C(C=C1)C(C)C(=O)O

Rapamycin, 99.0%, MP Biomedicals™

CAS: 53123-88-9 Molecular Formula: C51H79NO13 Molecular Weight (g/mol): 914.187 InChI Key: QFJCIRLUMZQUOT-HPLJOQBZSA-N Synonym: A422989, NSC226080 PubChem CID: 5284616 ChEBI: CHEBI:9168 SMILES: CC1CCC2CC(C(=CC=CC=CC(CC(C(=O)C(C(C(=CC(C(=O)CC(OC(=O)C3CCCCN3C(=O)C(=O)C1(O2)O)C(C)CC4CCC(C(C4)OC)O)C)C)O)OC)C)C)C)OC

trans-Ferulic Acid 98.0+%, TCI America™

CAS: 537-98-4 Molecular Formula: C10H10O4 Molecular Weight (g/mol): 194.186 MDL Number: MFCD00004400 InChI Key: KSEBMYQBYZTDHS-HWKANZROSA-N Synonym: 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 IUPAC Name: (E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoic acid SMILES: COC1=C(C=CC(=C1)C=CC(=O)O)O

Benzoin, 98%, Acros Organics

CAS: 119-53-9 Molecular Formula: C14H12O2 Molecular Weight (g/mol): 212.25 MDL Number: MFCD00004496 InChI Key: ISAOCJYIOMOJEB-UHFFFAOYSA-N Synonym: +--benzoin PubChem CID: 8400 ChEBI: CHEBI:17682 IUPAC Name: 2-hydroxy-1,2-diphenylethanone SMILES: C1=CC=C(C=C1)C(C(=O)C2=CC=CC=C2)O

Ononin 97.0+%, TCI America™

CAS: 486-62-4 Molecular Formula: C22H22O9 Molecular Weight (g/mol): 430.409 MDL Number: MFCD00017464 InChI Key: MGJLSBDCWOSMHL-MIUGBVLSSA-N Synonym: Formononetin 7-O-beta-D-glucopyranoside PubChem CID: 442813 ChEBI: CHEBI:7775 IUPAC Name: 3-(4-methoxyphenyl)-7-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one SMILES: COC1=CC=C(C=C1)C2=COC3=C(C2=O)C=CC(=C3)OC4C(C(C(C(O4)CO)O)O)O

Curcumin, 95% (total curcuminoid content), from Turmeric rhizome, Alfa Aesar™

CAS: 458-37-7 Molecular Formula: C21H20O6 Molecular Weight (g/mol): 368.385 MDL Number: MFCD00008365 InChI Key: VFLDPWHFBUODDF-FCXRPNKRSA-N Synonym: curcuma PubChem CID: 969516 ChEBI: CHEBI:3962 IUPAC Name: (1E,6E)-1,7-bis(4-hydroxy-3-methoxyphenyl)hepta-1,6-diene-3,5-dione SMILES: COC1=C(C=CC(=C1)C=CC(=O)CC(=O)C=CC2=CC(=C(C=C2)O)OC)O

Paraffin wax, pure, granular, Acros Organics

CAS: 8002-74-2 Molecular Formula: CnH2n+2 Molecular Weight (g/mol): 341.451 MDL Number: MFCD00132833 InChI Key: JWHAUXFOSRPERK-UHFFFAOYSA-N Synonym: gnf-pf-4594 PubChem CID: 4932 ChEBI: CHEBI:63619 IUPAC Name: 1-[2-[2-hydroxy-3-(propylamino)propoxy]phenyl]-3-phenylpropan-1-one SMILES: CCCNCC(COC1=CC=CC=C1C(=O)CCC2=CC=CC=C2)O

Coumarin 2, Laser Grade 99%, ACROS Organics™

CAS: 26078-25-1 Molecular Formula: C13H15NO2 Molecular Weight (g/mol): 217.268 MDL Number: MFCD00006860 InChI Key: QZXAEJGHNXJTSE-UHFFFAOYSA-N Synonym: 4, 6-Dimethyl-7-ethylaminocoumarin PubChem CID: 96929 IUPAC Name: 7-(ethylamino)-4,6-dimethylchromen-2-one SMILES: CCNC1=C(C=C2C(=CC(=O)OC2=C1)C)C

2-(4-Isobutylphenyl)propionic Acid 98.0+%, TCI America™

CAS: 15687-27-1 Molecular Formula: C13H18O2 Molecular Weight (g/mol): 206.285 MDL Number: MFCD00010393 InChI Key: HEFNNWSXXWATRW-UHFFFAOYSA-N Synonym: 2-4-isobutylphenyl propanoic acid PubChem CID: 3672 ChEBI: CHEBI:5855 IUPAC Name: 2-[4-(2-methylpropyl)phenyl]propanoic acid SMILES: CC(C)CC1=CC=C(C=C1)C(C)C(=O)O

Curcumin (mixture of curcumin, demethoxycurcumin, and bisdemethoxycurcumin), 98+%, Acros Organics

CAS: 458-37-7 Molecular Formula: C21H20O6 Molecular Weight (g/mol): 368.38 InChI Key: VFLDPWHFBUODDF-FCXRPNKRSA-N Synonym: curcuma PubChem CID: 969516 ChEBI: CHEBI:3962 IUPAC Name: (1E,6E)-1,7-bis(4-hydroxy-3-methoxyphenyl)hepta-1,6-diene-3,5-dione SMILES: COC1=C(C=CC(=C1)C=CC(=O)CC(=O)C=CC2=CC(=C(C=C2)O)OC)O

Methyl Calcein Blue Hydrate [Indicator for complexometry Copper], TCI America™

CAS: 81028-96-8 Molecular Formula: C14H15NO5 Molecular Weight (g/mol): 277.276 MDL Number: MFCD00167005 InChI Key: KRMRPQPGZHQMDD-UHFFFAOYSA-N Synonym: 4-Methylumbelliferonemethylene-N-methylglycine PubChem CID: 5384392 IUPAC Name: 2-[(7-hydroxy-4-methyl-2-oxochromen-6-yl)methyl-methylamino]acetic acid SMILES: CC1=CC(=O)OC2=CC(=C(C=C12)CN(C)CC(=O)O)O

Paraffin, liquid, pure, ACROS Organics™

CAS: 8012-95-1 Molecular Formula: C15H11ClO7 Molecular Weight (g/mol): 338.696 MDL Number: MFCD00131611 InChI Key: FFNDMZIBVDSQFI-UHFFFAOYSA-N Synonym: 3,5,7-trihydroxy-2-3,4,5-trihydroxyphenyl benzopyrylium chloride PubChem CID: 68245 ChEBI: CHEBI:38701 IUPAC Name: 2-(3,4,5-trihydroxyphenyl)chromenylium-3,5,7-triol;chloride SMILES: C1=C(C=C(C(=C1O)O)O)C2=C(C=C3C(=CC(=CC3=[O+]2)O)O)O.[Cl-]

2,3-Dibromo-3-phenylpropionic Acid 98.0+%, TCI America™

CAS: 6286-30-2 Molecular Formula: C9H8Br2O2 Molecular Weight (g/mol): 307.969 MDL Number: MFCD00004208 InChI Key: FXJWTHBNVZNQQP-UHFFFAOYSA-N Synonym: alpha,beta-Dibromohydrocinnamic Acid PubChem CID: 22705 IUPAC Name: 2,3-dibromo-3-phenylpropanoic acid SMILES: C1=CC=C(C=C1)C(C(C(=O)O)Br)Br

trans-Cinnamaldehyde 98.0+%, TCI America™

CAS: 14371-10-9 Molecular Formula: C9H8O Molecular Weight (g/mol): 132.162 MDL Number: MFCD00007000 InChI Key: KJPRLNWUNMBNBZ-QPJJXVBHSA-N Synonym: 2e-3-phenylprop-2-enal PubChem CID: 637511 ChEBI: CHEBI:16731 IUPAC Name: (E)-3-phenylprop-2-enal SMILES: C1=CC=C(C=C1)C=CC=O

Phloretin, 98%, ACROS Organics™

CAS: 60-82-2 Molecular Formula: C15H14O5 Molecular Weight (g/mol): 274.27 MDL Number: MFCD00002288 InChI Key: VGEREEWJJVICBM-UHFFFAOYSA-N Synonym: 1-propanone, 3-4-hydroxyphenyl-1-2,4,6-trihydroxyphenyl PubChem CID: 4788 ChEBI: CHEBI:17276 IUPAC Name: 3-(4-hydroxyphenyl)-1-(2,4,6-trihydroxyphenyl)propan-1-one SMILES: C1=CC(=CC=C1CCC(=O)C2=C(C=C(C=C2O)O)O)O

3-(4-Hydroxy-3-methoxyphenyl)propionic Acid 98.0+%, TCI America™

CAS: 1135-23-5 Molecular Formula: C10H12O4 Molecular Weight (g/mol): 196.202 InChI Key: BOLQJTPHPSDZHR-UHFFFAOYSA-N Synonym: 3-4-hydroxy-3-methoxyphenyl propanoic acid, 3-4-hydroxy-3-methoxyphenyl propionic acid, dihydroferulic acid, hydroferulic acid, dihydroconiferylic acid, unii-o01rnc700m, benzenepropanoic acid, 4-hydroxy-3-methoxy, 3-4-hydroxymethyl propionic acid, .beta.-4-hydroxy-3-methoxyphenyl propionic acid, 3-4-hydroxy-3-methoxy-phenyl propanoic acid PubChem CID: 14340 ChEBI: CHEBI:86612 IUPAC Name: 3-(4-hydroxy-3-methoxyphenyl)propanoic acid SMILES: COC1=C(C=CC(=C1)CCC(=O)O)O

Rifabutin, 98%, Acros Organics™

CAS: 72559-06-9 Molecular Formula: C46H62N4O11 Molecular Weight (g/mol): 847 InChI Key: ATEBXHFBFRCZMA-WBGWULMVSA-N Synonym: alfacid PubChem CID: 57448257 SMILES: CC1C=CC=C(C(=O)NC2=C3C(=NC4(N3)CCN(CC4)CC(C)C)C5=C6C(=C(C(=C5C2=O)O)C)OC(C6=O)(OC=CC(C(C(C(C(C(C1O)C)O)C)OC(=O)C)C)OC)C)C

Rapamycin, Fisher BioReagents

CAS: 53123-88-9 Molecular Formula: C51H79NO13 Molecular Weight (g/mol): 914.187 InChI Key: QFJCIRLUMZQUOT-HPLJOQBZSA-N PubChem CID: 5284616 ChEBI: CHEBI:9168 SMILES: CC1CCC2CC(C(=CC=CC=CC(CC(C(=O)C(C(C(=CC(C(=O)CC(OC(=O)C3CCCCN3C(=O)C(=O)C1(O2)O)C(C)CC4CCC(C(C4)OC)O)C)C)O)OC)C)C)C)OC

Doxorubicin Hydrochloride, Fisher BioReagents

CAS: 25316-40-9 Molecular Formula: C27H30ClNO11 Molecular Weight (g/mol): 579.983 InChI Key: MWWSFMDVAYGXBV-BXPPNZEESA-N Synonym: adriacin PubChem CID: 129626538 IUPAC Name: (7R,9R)-7-[(2S,4R,5R,6R)-4-amino-5-hydroxy-6-methyloxan-2-yl]oxy-6,9,11-trihydroxy-9-(2-hydroxyacetyl)-4-methoxy-8,10-dihydro-7H-tetracene-5,12-dione;hydrochloride SMILES: CC1C(C(CC(O1)OC2CC(CC3=C(C4=C(C(=C23)O)C(=O)C5=C(C4=O)C=CC=C5OC)O)(C(=O)CO)O)N)O.Cl

Genistein, 99%, synthetic, ACROS Organics™

CAS: 446-72-0 Molecular Formula: C15H10O5 Molecular Weight (g/mol): 270.2 MDL Number: MFCD00016952 InChI Key: TZBJGXHYKVUXJN-UHFFFAOYSA-N Synonym: 4',5,7-trihydroxyisoflavone PubChem CID: 5280961 ChEBI: CHEBI:28088 IUPAC Name: 5,7-dihydroxy-3-(4-hydroxyphenyl)chromen-4-one SMILES: C1=CC(=CC=C1C2=COC3=CC(=CC(=C3C2=O)O)O)O

trans-Cinnamaldehyde, 99%, ACROS Organics™

CAS: 14371-10-9 Molecular Formula: C9H8O Molecular Weight (g/mol): 132.16 InChI Key: KJPRLNWUNMBNBZ-QPJJXVBHSA-N Synonym: 2e-3-phenylprop-2-enal PubChem CID: 637511 ChEBI: CHEBI:16731 IUPAC Name: (E)-3-phenylprop-2-enal SMILES: C1=CC=C(C=C1)C=CC=O

Paraffin Oil Heavy, MilliporeSigma™

CAS: 8012-95-1 Molecular Formula: C15H11ClO7 Molecular Weight (g/mol): 338.696 InChI Key: FFNDMZIBVDSQFI-UHFFFAOYSA-N Synonym: 3,5,7-trihydroxy-2-3,4,5-trihydroxyphenyl benzopyrylium chloride PubChem CID: 68245 ChEBI: CHEBI:38701 IUPAC Name: 2-(3,4,5-trihydroxyphenyl)chromenylium-3,5,7-triol;chloride SMILES: C1=C(C=C(C(=C1O)O)O)C2=C(C=C3C(=CC(=CC3=[O+]2)O)O)O.[Cl-]

4-Methylumbelliferone 98.0+%, TCI America™

CAS: 90-33-5 Molecular Formula: C10H8O3 Molecular Weight (g/mol): 176.171 MDL Number: MFCD00006866 InChI Key: HSHNITRMYYLLCV-UHFFFAOYSA-N Synonym: 4-methylumbelliferone, hymecromone, 7-hydroxy-4-methylcoumarin, imecromone, 7-hydroxy-4-methyl-2h-chromen-2-one, cholestil, mendiaxon, 4-methyl-7-hydroxycoumarin, beta-methylumbelliferone, bilcolic PubChem CID: 5280567 ChEBI: CHEBI:17224 IUPAC Name: 7-hydroxy-4-methylchromen-2-one SMILES: CC1=CC(=O)OC2=C1C=CC(=C2)O

alpha-Cyano-4-hydroxycinnamic Acid 98.0+%, TCI America™

CAS: 28166-41-8 Molecular Formula: C10H7NO3 Molecular Weight (g/mol): 189.17 MDL Number: MFCD00004204 InChI Key: AFVLVVWMAFSXCK-YVMONPNESA-N Synonym: 2-cyano-3-4-hydroxyphe-nyl acrylic 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

Curcumin (Natural), TCI America™

CAS: 458-37-7 Molecular Formula: C21H20O6 Molecular Weight (g/mol): 368.385 MDL Number: MFCD00008365 InChI Key: VFLDPWHFBUODDF-FCXRPNKRSA-N Synonym: curcuma PubChem CID: 969516 ChEBI: CHEBI:3962 IUPAC Name: (1E,6E)-1,7-bis(4-hydroxy-3-methoxyphenyl)hepta-1,6-diene-3,5-dione SMILES: COC1=C(C=CC(=C1)C=CC(=O)CC(=O)C=CC2=CC(=C(C=C2)O)OC)O

Alfa Aesar™ 1,3-Diphenylacetone, 98+%

CAS: 102-04-5 Molecular Formula: C15H14O Molecular Weight (g/mol): 210.276 MDL Number: MFCD00004795 InChI Key: YFKBXYGUSOXJGS-UHFFFAOYSA-N Synonym: 1,3-diphenyl-2-propanone PubChem CID: 7593 IUPAC Name: 1,3-diphenylpropan-2-one SMILES: C1=CC=C(C=C1)CC(=O)CC2=CC=CC=C2

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