Phenylpropanoids and polyketides
Filtered Search Results
alpha-Hexylcinnamaldehyde 90.0+%, TCI America™
CAS: 101-86-0 Molecular Formula: C15H20O Molecular Weight (g/mol): 216.32 MDL Number: MFCD00006989 InChI Key: GUUHFMWKWLOQMM-NTCAYCPXSA-N Synonym: 2-Hexyl-3-phenylacrylaldehyde, 2-Hexyl-3-phenyl-2-propenal PubChem CID: 1715135 IUPAC Name: (2E)-2-(phenylmethylidene)octanal SMILES: CCCCCC\C(C=O)=C/C1=CC=CC=C1
| PubChem CID | 1715135 |
|---|---|
| CAS | 101-86-0 |
| Molecular Weight (g/mol) | 216.32 |
| MDL Number | MFCD00006989 |
| SMILES | CCCCCC\C(C=O)=C/C1=CC=CC=C1 |
| Synonym | 2-Hexyl-3-phenylacrylaldehyde, 2-Hexyl-3-phenyl-2-propenal |
| IUPAC Name | (2E)-2-(phenylmethylidene)octanal |
| InChI Key | GUUHFMWKWLOQMM-NTCAYCPXSA-N |
| Molecular Formula | C15H20O |
Ethyl 7-(Diethylamino)coumarin-3-carboxylate 98.0+%, TCI America™
CAS: 28705-46-6 Molecular Formula: C16H19NO4 Molecular Weight (g/mol): 289.331 MDL Number: MFCD00227484 InChI Key: MSOLGAJLRIINNF-UHFFFAOYSA-N Synonym: 7-(Diethylamino)coumarin-3-carboxylic Acid Ethyl Ester PubChem CID: 120014 IUPAC Name: ethyl 7-(diethylamino)-2-oxochromene-3-carboxylate SMILES: CCN(CC)C1=CC2=C(C=C1)C=C(C(=O)O2)C(=O)OCC
| PubChem CID | 120014 |
|---|---|
| CAS | 28705-46-6 |
| Molecular Weight (g/mol) | 289.331 |
| MDL Number | MFCD00227484 |
| SMILES | CCN(CC)C1=CC2=C(C=C1)C=C(C(=O)O2)C(=O)OCC |
| Synonym | 7-(Diethylamino)coumarin-3-carboxylic Acid Ethyl Ester |
| IUPAC Name | ethyl 7-(diethylamino)-2-oxochromene-3-carboxylate |
| InChI Key | MSOLGAJLRIINNF-UHFFFAOYSA-N |
| Molecular Formula | C16H19NO4 |
trans-Cinnamic Acid 98.0+%, TCI America™
CAS: 140-10-3 Molecular Formula: C9H8O2 Molecular Weight (g/mol): 148.161 MDL Number: MFCD00004369 InChI Key: WBYWAXJHAXSJNI-VOTSOKGWSA-N Synonym: cinnamic acid,trans-cinnamic acid,e-cinnamic acid,3-phenylacrylic acid,trans-3-phenylacrylic acid,zimtsaeure,2e-3-phenylprop-2-enoic acid,3-phenylprop-2-enoic acid,3-phenylpropenoic acid PubChem CID: 444539 ChEBI: CHEBI:35697 IUPAC Name: (E)-3-phenylprop-2-enoic acid SMILES: C1=CC=C(C=C1)C=CC(=O)O
| PubChem CID | 444539 |
|---|---|
| CAS | 140-10-3 |
| Molecular Weight (g/mol) | 148.161 |
| ChEBI | CHEBI:35697 |
| MDL Number | MFCD00004369 |
| SMILES | C1=CC=C(C=C1)C=CC(=O)O |
| Synonym | cinnamic acid,trans-cinnamic acid,e-cinnamic acid,3-phenylacrylic acid,trans-3-phenylacrylic acid,zimtsaeure,2e-3-phenylprop-2-enoic acid,3-phenylprop-2-enoic acid,3-phenylpropenoic acid |
| IUPAC Name | (E)-3-phenylprop-2-enoic acid |
| InChI Key | WBYWAXJHAXSJNI-VOTSOKGWSA-N |
| Molecular Formula | C9H8O2 |
Benzoin 98.0+%, TCI America™
CAS: 119-53-9 Molecular Formula: C14H12O2 Molecular Weight (g/mol): 212.25 MDL Number: MFCD00004496 InChI Key: ISAOCJYIOMOJEB-UHFFFAOYNA-N Synonym: benzoin,2-hydroxy-2-phenylacetophenone,benzoylphenylcarbinol,benzoin tincture,+--benzoin,ethanone, 2-hydroxy-1,2-diphenyl,bitter almond oil camphor,phenylbenzoyl carbinol,2-hydroxy-1,2-diphenylethan-1-one,alpha-hydroxybenzyl phenyl ketone PubChem CID: 8400 ChEBI: CHEBI:17682 IUPAC Name: 2-hydroxy-1,2-diphenylethan-1-one SMILES: OC(C(=O)C1=CC=CC=C1)C1=CC=CC=C1
| PubChem CID | 8400 |
|---|---|
| CAS | 119-53-9 |
| Molecular Weight (g/mol) | 212.25 |
| ChEBI | CHEBI:17682 |
| MDL Number | MFCD00004496 |
| SMILES | OC(C(=O)C1=CC=CC=C1)C1=CC=CC=C1 |
| Synonym | benzoin,2-hydroxy-2-phenylacetophenone,benzoylphenylcarbinol,benzoin tincture,+--benzoin,ethanone, 2-hydroxy-1,2-diphenyl,bitter almond oil camphor,phenylbenzoyl carbinol,2-hydroxy-1,2-diphenylethan-1-one,alpha-hydroxybenzyl phenyl ketone |
| IUPAC Name | 2-hydroxy-1,2-diphenylethan-1-one |
| InChI Key | ISAOCJYIOMOJEB-UHFFFAOYNA-N |
| Molecular Formula | C14H12O2 |
3,5-Dimethoxy-4-hydroxycinnamic Acid 98.0+%, TCI America™
CAS: 530-59-6 Molecular Formula: C11H12O5 Molecular Weight (g/mol): 224.212 MDL Number: MFCD00004401 InChI Key: PCMORTLOPMLEFB-ONEGZZNKSA-N Synonym: sinapic acid,sinapinic acid,3,5-dimethoxy-4-hydroxycinnamic acid,sinapinate,sinapate,trans-sinapic acid,4-hydroxy-3,5-dimethoxycinnamic acid,synapoic acid,2e-3-4-hydroxy-3,5-dimethoxyphenyl prop-2-enoic acid,unii-p0i60993ec PubChem CID: 637775 ChEBI: CHEBI:15714 IUPAC Name: (E)-3-(4-hydroxy-3,5-dimethoxyphenyl)prop-2-enoic acid SMILES: COC1=CC(=CC(=C1O)OC)C=CC(=O)O
| PubChem CID | 637775 |
|---|---|
| CAS | 530-59-6 |
| Molecular Weight (g/mol) | 224.212 |
| ChEBI | CHEBI:15714 |
| MDL Number | MFCD00004401 |
| SMILES | COC1=CC(=CC(=C1O)OC)C=CC(=O)O |
| Synonym | sinapic acid,sinapinic acid,3,5-dimethoxy-4-hydroxycinnamic acid,sinapinate,sinapate,trans-sinapic acid,4-hydroxy-3,5-dimethoxycinnamic acid,synapoic acid,2e-3-4-hydroxy-3,5-dimethoxyphenyl prop-2-enoic acid,unii-p0i60993ec |
| IUPAC Name | (E)-3-(4-hydroxy-3,5-dimethoxyphenyl)prop-2-enoic acid |
| InChI Key | PCMORTLOPMLEFB-ONEGZZNKSA-N |
| Molecular Formula | C11H12O5 |
Nobiletin 95.0+%, TCI America™
CAS: 478-01-3 Molecular Formula: C21H22O8 Molecular Weight (g/mol): 402.399 MDL Number: MFCD03273560 InChI Key: MRIAQLRQZPPODS-UHFFFAOYSA-N PubChem CID: 72344 ChEBI: CHEBI:7602 IUPAC Name: 2-(3,4-dimethoxyphenyl)-5,6,7,8-tetramethoxychromen-4-one SMILES: COC1=C(C=C(C=C1)C2=CC(=O)C3=C(O2)C(=C(C(=C3OC)OC)OC)OC)OC
| PubChem CID | 72344 |
|---|---|
| CAS | 478-01-3 |
| Molecular Weight (g/mol) | 402.399 |
| ChEBI | CHEBI:7602 |
| MDL Number | MFCD03273560 |
| SMILES | COC1=C(C=C(C=C1)C2=CC(=O)C3=C(O2)C(=C(C(=C3OC)OC)OC)OC)OC |
| IUPAC Name | 2-(3,4-dimethoxyphenyl)-5,6,7,8-tetramethoxychromen-4-one |
| InChI Key | MRIAQLRQZPPODS-UHFFFAOYSA-N |
| Molecular Formula | C21H22O8 |
Benzylmalonic Acid 98.0+%, TCI America™
CAS: 616-75-1 Molecular Formula: C10H10O4 Molecular Weight (g/mol): 194.19 MDL Number: MFCD00004261 InChI Key: JAEJSNFTJMYIEF-UHFFFAOYSA-N PubChem CID: 12031 IUPAC Name: 2-benzylpropanedioic acid SMILES: OC(=O)C(CC1=CC=CC=C1)C(O)=O
| PubChem CID | 12031 |
|---|---|
| CAS | 616-75-1 |
| Molecular Weight (g/mol) | 194.19 |
| MDL Number | MFCD00004261 |
| SMILES | OC(=O)C(CC1=CC=CC=C1)C(O)=O |
| IUPAC Name | 2-benzylpropanedioic acid |
| InChI Key | JAEJSNFTJMYIEF-UHFFFAOYSA-N |
| Molecular Formula | C10H10O4 |
3,6-Dihydroxyflavone 98.0+%, TCI America™
CAS: 108238-41-1 Molecular Formula: C15H10O4 Molecular Weight (g/mol): 254.241 MDL Number: MFCD00143082 InChI Key: XHLOLFKZCUCROE-UHFFFAOYSA-N Synonym: 3,6-dihydroxyflavone,3,6-dihydroxy-2-phenyl-4h-chromen-4-one,6-hydroxyflavonol,3,6-dihydroxy-flavone,4h-1-benzopyran-4-one, 3,6-dihydroxy-2-phenyl,acmc-1c7fz,3,6-dihydroxy-2-phenylchromone PubChem CID: 688659 IUPAC Name: 3,6-dihydroxy-2-phenylchromen-4-one SMILES: C1=CC=C(C=C1)C2=C(C(=O)C3=C(O2)C=CC(=C3)O)O
| PubChem CID | 688659 |
|---|---|
| CAS | 108238-41-1 |
| Molecular Weight (g/mol) | 254.241 |
| MDL Number | MFCD00143082 |
| SMILES | C1=CC=C(C=C1)C2=C(C(=O)C3=C(O2)C=CC(=C3)O)O |
| Synonym | 3,6-dihydroxyflavone,3,6-dihydroxy-2-phenyl-4h-chromen-4-one,6-hydroxyflavonol,3,6-dihydroxy-flavone,4h-1-benzopyran-4-one, 3,6-dihydroxy-2-phenyl,acmc-1c7fz,3,6-dihydroxy-2-phenylchromone |
| IUPAC Name | 3,6-dihydroxy-2-phenylchromen-4-one |
| InChI Key | XHLOLFKZCUCROE-UHFFFAOYSA-N |
| Molecular Formula | C15H10O4 |
Bis[rhodium(alpha,alpha,alpha',alpha'-tetramethyl-1,3-benzenedipropionic Acid)] 96.0+%, TCI America™
CAS: 819050-89-0 Molecular Formula: C32H40O8Rh2 Molecular Weight (g/mol): 758.48 MDL Number: MFCD08457636 InChI Key: AHCPGXZDVSBJII-UHFFFAOYSA-J Synonym: Rh2(esp)2 PubChem CID: 131885550 IUPAC Name: bis(λ²-rhodium(2+)) bis(3-[3-(2-carboxylato-2,2-dimethylethyl)phenyl]-2,2-dimethylpropanoate) SMILES: [Rh++].[Rh++].CC(C)(CC1=CC(CC(C)(C)C([O-])=O)=CC=C1)C([O-])=O.CC(C)(CC1=CC(CC(C)(C)C([O-])=O)=CC=C1)C([O-])=O
| PubChem CID | 131885550 |
|---|---|
| CAS | 819050-89-0 |
| Molecular Weight (g/mol) | 758.48 |
| MDL Number | MFCD08457636 |
| SMILES | [Rh++].[Rh++].CC(C)(CC1=CC(CC(C)(C)C([O-])=O)=CC=C1)C([O-])=O.CC(C)(CC1=CC(CC(C)(C)C([O-])=O)=CC=C1)C([O-])=O |
| Synonym | Rh2(esp)2 |
| IUPAC Name | bis(λ²-rhodium(2+)) bis(3-[3-(2-carboxylato-2,2-dimethylethyl)phenyl]-2,2-dimethylpropanoate) |
| InChI Key | AHCPGXZDVSBJII-UHFFFAOYSA-J |
| Molecular Formula | C32H40O8Rh2 |
8-Acetyl-7-hydroxy-4-methylcoumarin 98.0+%, TCI America™
CAS: 2555-29-5 Molecular Formula: C12H10O4 Molecular Weight (g/mol): 218.21 MDL Number: MFCD00100602 InChI Key: WZOMQVFUPMLOGT-UHFFFAOYSA-N Synonym: 8-Acetyl-4-methylumbelliferone PubChem CID: 5324648 IUPAC Name: 8-acetyl-7-hydroxy-4-methyl-2H-chromen-2-one SMILES: CC(=O)C1=C2OC(=O)C=C(C)C2=CC=C1O
| PubChem CID | 5324648 |
|---|---|
| CAS | 2555-29-5 |
| Molecular Weight (g/mol) | 218.21 |
| MDL Number | MFCD00100602 |
| SMILES | CC(=O)C1=C2OC(=O)C=C(C)C2=CC=C1O |
| Synonym | 8-Acetyl-4-methylumbelliferone |
| IUPAC Name | 8-acetyl-7-hydroxy-4-methyl-2H-chromen-2-one |
| InChI Key | WZOMQVFUPMLOGT-UHFFFAOYSA-N |
| Molecular Formula | C12H10O4 |
4-Aminohydrocinnamic Acid 98.0+%, TCI America™
CAS: 2393-17-1 Molecular Formula: C9H11NO2 Molecular Weight (g/mol): 165.192 MDL Number: MFCD00017118 InChI Key: WXOHKMNWMKZMND-UHFFFAOYSA-N Synonym: 3-4-aminophenyl propionic acid,3-4-aminophenyl propanoic acid,4-aminohydrocinnamic acid,benzenepropanoic acid, 4-amino,3-p-aminophenyl propionic acid,beta-p-aminophenyl propionic acid,p-aminohydrocinnamic acid,4-aminobenzenepropanoic acid,benzenepropanoic acid,4-amino,beta-4-aminophenyl propionic acid PubChem CID: 75451 IUPAC Name: 3-(4-aminophenyl)propanoic acid SMILES: C1=CC(=CC=C1CCC(=O)O)N
| PubChem CID | 75451 |
|---|---|
| CAS | 2393-17-1 |
| Molecular Weight (g/mol) | 165.192 |
| MDL Number | MFCD00017118 |
| SMILES | C1=CC(=CC=C1CCC(=O)O)N |
| Synonym | 3-4-aminophenyl propionic acid,3-4-aminophenyl propanoic acid,4-aminohydrocinnamic acid,benzenepropanoic acid, 4-amino,3-p-aminophenyl propionic acid,beta-p-aminophenyl propionic acid,p-aminohydrocinnamic acid,4-aminobenzenepropanoic acid,benzenepropanoic acid,4-amino,beta-4-aminophenyl propionic acid |
| IUPAC Name | 3-(4-aminophenyl)propanoic acid |
| InChI Key | WXOHKMNWMKZMND-UHFFFAOYSA-N |
| Molecular Formula | C9H11NO2 |
7-Acetoxy-4-methylcoumarin 98.0+%, TCI America™
CAS: 5-9-2747 Molecular Formula: C12H10O4 Molecular Weight (g/mol): 218.21 MDL Number: MFCD00006865 InChI Key: HXVZGASCDAGAPS-UHFFFAOYSA-N Synonym: 7-acetoxy-4-methylcoumarin,4-methylumbelliferyl acetate,4-methyl-2-oxo-2h-chromen-7-yl acetate,mu-ac,2h-1-benzopyran-2-one, 7-acetyloxy-4-methyl,7-acetyl-4-methylcoumarin,beta-methylumbelliferyl acetate,7-acetyloxy-4-methyl-2-benzopyrone,4-methyl-2-oxochromen-7-yl acetate,4-methyl-7-acetyloxy coumarin PubChem CID: 366 ChEBI: CHEBI:17763 IUPAC Name: (4-methyl-2-oxochromen-7-yl) acetate SMILES: CC1=CC(=O)OC2=C1C=CC(=C2)OC(=O)C
| PubChem CID | 366 |
|---|---|
| CAS | 5-9-2747 |
| Molecular Weight (g/mol) | 218.21 |
| ChEBI | CHEBI:17763 |
| MDL Number | MFCD00006865 |
| SMILES | CC1=CC(=O)OC2=C1C=CC(=C2)OC(=O)C |
| Synonym | 7-acetoxy-4-methylcoumarin,4-methylumbelliferyl acetate,4-methyl-2-oxo-2h-chromen-7-yl acetate,mu-ac,2h-1-benzopyran-2-one, 7-acetyloxy-4-methyl,7-acetyl-4-methylcoumarin,beta-methylumbelliferyl acetate,7-acetyloxy-4-methyl-2-benzopyrone,4-methyl-2-oxochromen-7-yl acetate,4-methyl-7-acetyloxy coumarin |
| IUPAC Name | (4-methyl-2-oxochromen-7-yl) acetate |
| InChI Key | HXVZGASCDAGAPS-UHFFFAOYSA-N |
| Molecular Formula | C12H10O4 |
Stilbazo [Spectrophotometric reagent for Al and other metals], TCI America™
CAS: 1571-36-4 Molecular Formula: C26H26N6O10S2 Molecular Weight (g/mol): 646.646 MDL Number: MFCD00045752 InChI Key: WMIFGUMCCUZRTH-SEPHDYHBSA-N Synonym: Stilbene-4,4′C-bis[(1-azo)-3,4-dihydroxybenzene]-2,2′C-disulfonic Acid Diammonium Salt PubChem CID: 87194021 IUPAC Name: azane;5-[2-(3,4-dioxocyclohexa-1,5-dien-1-yl)hydrazinyl]-2-[(E)-2-[4-[2-(3,4-dioxocyclohexa-1,5-dien-1-yl)hydrazinyl]-2-sulfophenyl]ethenyl]benzenesulfonic acid SMILES: C1=CC(=C(C=C1NNC2=CC(=O)C(=O)C=C2)S(=O)(=O)O)C=CC3=C(C=C(C=C3)NNC4=CC(=O)C(=O)C=C4)S(=O)(=O)O.N.N
| PubChem CID | 87194021 |
|---|---|
| CAS | 1571-36-4 |
| Molecular Weight (g/mol) | 646.646 |
| MDL Number | MFCD00045752 |
| SMILES | C1=CC(=C(C=C1NNC2=CC(=O)C(=O)C=C2)S(=O)(=O)O)C=CC3=C(C=C(C=C3)NNC4=CC(=O)C(=O)C=C4)S(=O)(=O)O.N.N |
| Synonym | Stilbene-4,4′C-bis[(1-azo)-3,4-dihydroxybenzene]-2,2′C-disulfonic Acid Diammonium Salt |
| IUPAC Name | azane;5-[2-(3,4-dioxocyclohexa-1,5-dien-1-yl)hydrazinyl]-2-[(E)-2-[4-[2-(3,4-dioxocyclohexa-1,5-dien-1-yl)hydrazinyl]-2-sulfophenyl]ethenyl]benzenesulfonic acid |
| InChI Key | WMIFGUMCCUZRTH-SEPHDYHBSA-N |
| Molecular Formula | C26H26N6O10S2 |
7-Acetoxy-4-bromomethylcoumarin 98.0+%, TCI America™
CAS: 4-8-2747 Molecular Formula: C12H9BrO4 Molecular Weight (g/mol): 297.10 MDL Number: MFCD00010707 InChI Key: YDJFMNSSDOXBSR-UHFFFAOYSA-N PubChem CID: 188296 IUPAC Name: [4-(bromomethyl)-2-oxochromen-7-yl] acetate SMILES: CC(=O)OC1=CC2=C(C=C1)C(=CC(=O)O2)CBr
| PubChem CID | 188296 |
|---|---|
| CAS | 4-8-2747 |
| Molecular Weight (g/mol) | 297.10 |
| MDL Number | MFCD00010707 |
| SMILES | CC(=O)OC1=CC2=C(C=C1)C(=CC(=O)O2)CBr |
| IUPAC Name | [4-(bromomethyl)-2-oxochromen-7-yl] acetate |
| InChI Key | YDJFMNSSDOXBSR-UHFFFAOYSA-N |
| Molecular Formula | C12H9BrO4 |
3-Acetamidocoumarin 98.0+%, TCI America™
CAS: 779-30-6 Molecular Formula: C11H9NO3 Molecular Weight (g/mol): 203.20 MDL Number: MFCD00075556 InChI Key: XJYLCCJIDYSFMB-UHFFFAOYSA-N PubChem CID: 136620 IUPAC Name: N-(2-oxo-2H-chromen-3-yl)acetamide SMILES: CC(=O)NC1=CC2=CC=CC=C2OC1=O
| PubChem CID | 136620 |
|---|---|
| CAS | 779-30-6 |
| Molecular Weight (g/mol) | 203.20 |
| MDL Number | MFCD00075556 |
| SMILES | CC(=O)NC1=CC2=CC=CC=C2OC1=O |
| IUPAC Name | N-(2-oxo-2H-chromen-3-yl)acetamide |
| InChI Key | XJYLCCJIDYSFMB-UHFFFAOYSA-N |
| Molecular Formula | C11H9NO3 |