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Phenylpropanoids and polyketides

Phenylpropaniods are organic compounds characterized by having an aromatic ring and a three-carbon propene tail. Polyketides are compounds characterized by having two or more carbonyl functional groups connected with a single carbon atom.
Flavonoids (890)
Cinnamic acids and derivatives (865)
Coumarins and derivatives (685)
Linear 1 3-diarylpropanoids (472)
Phenylpropanoic acids (332)
Depsides and depsidones (304)
Isoflavonoids (206)
Cinnamaldehydes (119)
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Dihydrocoumarins (16)
Neoflavonoids (14)
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661 – 675 of 3,687 results
661

6,7-Dimethoxy-4-methylcoumarin 98.0+%, TCI America™

CAS: 4281-40-7 Molecular Formula: C12H12O4 Molecular Weight (g/mol): 220.224 MDL Number: MFCD00012338 InChI Key: GBYDSYPGGDKWGZ-UHFFFAOYSA-N PubChem CID: 77966 IUPAC Name: 6,7-dimethoxy-4-methylchromen-2-one SMILES: CC1=CC(=O)OC2=CC(=C(C=C12)OC)OC

PubChem CID 77966
CAS 4281-40-7
Molecular Weight (g/mol) 220.224
MDL Number MFCD00012338
SMILES CC1=CC(=O)OC2=CC(=C(C=C12)OC)OC
IUPAC Name 6,7-dimethoxy-4-methylchromen-2-one
InChI Key GBYDSYPGGDKWGZ-UHFFFAOYSA-N
Molecular Formula C12H12O4
662

7-Methoxy-4-methylcoumarin 98.0+%, TCI America™

CAS: 2555-28-4 Molecular Formula: C11H10O3 Molecular Weight (g/mol): 190.198 MDL Number: MFCD00009773 InChI Key: UDFPKNSWSYBIHO-UHFFFAOYSA-N Synonym: 7-methoxy-4-methylcoumarin,7-methoxy-4-methyl-2h-chromen-2-one,2h-1-benzopyran-2-one, 7-methoxy-4-methyl,4-methylherniarin,hymecromone methyl ether,herniarin, 4-methyl,7-methoxy-4-methyl-chromen-2-one,4-methyl-7-methoxycoumarin,coumarin,4-methyl-7-methoxy,coumarin, 7-methoxy-4-methyl PubChem CID: 390807 IUPAC Name: 7-methoxy-4-methylchromen-2-one SMILES: CC1=CC(=O)OC2=C1C=CC(=C2)OC

PubChem CID 390807
CAS 2555-28-4
Molecular Weight (g/mol) 190.198
MDL Number MFCD00009773
SMILES CC1=CC(=O)OC2=C1C=CC(=C2)OC
Synonym 7-methoxy-4-methylcoumarin,7-methoxy-4-methyl-2h-chromen-2-one,2h-1-benzopyran-2-one, 7-methoxy-4-methyl,4-methylherniarin,hymecromone methyl ether,herniarin, 4-methyl,7-methoxy-4-methyl-chromen-2-one,4-methyl-7-methoxycoumarin,coumarin,4-methyl-7-methoxy,coumarin, 7-methoxy-4-methyl
IUPAC Name 7-methoxy-4-methylchromen-2-one
InChI Key UDFPKNSWSYBIHO-UHFFFAOYSA-N
Molecular Formula C11H10O3
663

7-(Ethylamino)-4,6-dimethylcoumarin 98.0+%, TCI America™

CAS: 26078-25-1 Molecular Formula: C13H15NO2 Molecular Weight (g/mol): 217.268 MDL Number: MFCD00006860 InChI Key: QZXAEJGHNXJTSE-UHFFFAOYSA-N Synonym: coumarin 2,4,6-dimethyl-7-ethylamino coumarin,7-ethylamino-4,6-dimethyl coumarin,7-ethylamino-4,6-dimethyl-2h-chromen-2-one,7-ethylamino-4,6-dimethyl-chromen-2-one,4,6-dimethyl-7-ethylaminocoumarin,coumarin, 7-ethylamino-4,6-dimethyl,2h-1-benzopyran-2-one, 7-ethylamino-4,6-dimethyl,coumarin 450,ccris 4958 PubChem CID: 96929 IUPAC Name: 7-(ethylamino)-4,6-dimethylchromen-2-one SMILES: CCNC1=C(C=C2C(=CC(=O)OC2=C1)C)C

PubChem CID 96929
CAS 26078-25-1
Molecular Weight (g/mol) 217.268
MDL Number MFCD00006860
SMILES CCNC1=C(C=C2C(=CC(=O)OC2=C1)C)C
Synonym coumarin 2,4,6-dimethyl-7-ethylamino coumarin,7-ethylamino-4,6-dimethyl coumarin,7-ethylamino-4,6-dimethyl-2h-chromen-2-one,7-ethylamino-4,6-dimethyl-chromen-2-one,4,6-dimethyl-7-ethylaminocoumarin,coumarin, 7-ethylamino-4,6-dimethyl,2h-1-benzopyran-2-one, 7-ethylamino-4,6-dimethyl,coumarin 450,ccris 4958
IUPAC Name 7-(ethylamino)-4,6-dimethylchromen-2-one
InChI Key QZXAEJGHNXJTSE-UHFFFAOYSA-N
Molecular Formula C13H15NO2
664

7-Hydroxy-4-methylcoumarin-3-acetic Acid 97.0+%, TCI America™

CAS: 5852-10-8 Molecular Formula: C9H6N4O2 Molecular Weight (g/mol): 202.17 MDL Number: MFCD00467589 InChI Key: SGTFZCBIJHVSNT-UHFFFAOYSA-N Synonym: 4-Methylumbelliferone-3-acetic Acid PubChem CID: 5393149 IUPAC Name: 2-(7-hydroxy-4-methyl-2-oxochromen-3-yl)acetic acid SMILES: CC1=C(C(=O)OC2=C1C=CC(=C2)O)CC(=O)O

PubChem CID 5393149
CAS 5852-10-8
Molecular Weight (g/mol) 202.17
MDL Number MFCD00467589
SMILES CC1=C(C(=O)OC2=C1C=CC(=C2)O)CC(=O)O
Synonym 4-Methylumbelliferone-3-acetic Acid
IUPAC Name 2-(7-hydroxy-4-methyl-2-oxochromen-3-yl)acetic acid
InChI Key SGTFZCBIJHVSNT-UHFFFAOYSA-N
Molecular Formula C9H6N4O2
665

7-Methoxycoumarin 98.0+%, TCI America™

CAS: 531-59-9 Molecular Formula: C10H8O3 Molecular Weight (g/mol): 176.171 MDL Number: MFCD00006876 InChI Key: LIIALPBMIOVAHH-UHFFFAOYSA-N Synonym: 7-methoxycoumarin,herniarin,ayapanin,methylumbelliferone,7-methoxy-2h-chromen-2-one,herniarine,7-methoxy-2h-1-benzopyran-2-one,2h-1-benzopyran-2-one, 7-methoxy,coumarin, 7-methoxy,methoxycourmarin, 7 PubChem CID: 10748 ChEBI: CHEBI:5679 IUPAC Name: 7-methoxychromen-2-one SMILES: COC1=CC2=C(C=C1)C=CC(=O)O2

PubChem CID 10748
CAS 531-59-9
Molecular Weight (g/mol) 176.171
ChEBI CHEBI:5679
MDL Number MFCD00006876
SMILES COC1=CC2=C(C=C1)C=CC(=O)O2
Synonym 7-methoxycoumarin,herniarin,ayapanin,methylumbelliferone,7-methoxy-2h-chromen-2-one,herniarine,7-methoxy-2h-1-benzopyran-2-one,2h-1-benzopyran-2-one, 7-methoxy,coumarin, 7-methoxy,methoxycourmarin, 7
IUPAC Name 7-methoxychromen-2-one
InChI Key LIIALPBMIOVAHH-UHFFFAOYSA-N
Molecular Formula C10H8O3
666

5-Methylumbelliferone 95.0+%, TCI America™

CAS: 7249-26-5 Molecular Formula: C10H8O3 Molecular Weight (g/mol): 176.171 MDL Number: MFCD00488356 InChI Key: QNDMQTVAGWUUDS-UHFFFAOYSA-N Synonym: 7-Hydroxy-5-methylcoumarin PubChem CID: 5355639 IUPAC Name: 7-hydroxy-5-methylchromen-2-one SMILES: CC1=CC(=CC2=C1C=CC(=O)O2)O

PubChem CID 5355639
CAS 7249-26-5
Molecular Weight (g/mol) 176.171
MDL Number MFCD00488356
SMILES CC1=CC(=CC2=C1C=CC(=O)O2)O
Synonym 7-Hydroxy-5-methylcoumarin
IUPAC Name 7-hydroxy-5-methylchromen-2-one
InChI Key QNDMQTVAGWUUDS-UHFFFAOYSA-N
Molecular Formula C10H8O3
667

6-Bromocoumarin-3-carboxylic Acid 98.0+%, TCI America™

CAS: 2199-87-3 Molecular Formula: C10H5BrO4 Molecular Weight (g/mol): 269.05 MDL Number: MFCD00047640 InChI Key: XFQHPAXNKDYMOX-UHFFFAOYSA-N PubChem CID: 694463 IUPAC Name: 6-bromo-2-oxochromene-3-carboxylic acid SMILES: C1=CC2=C(C=C1Br)C=C(C(=O)O2)C(=O)O

PubChem CID 694463
CAS 2199-87-3
Molecular Weight (g/mol) 269.05
MDL Number MFCD00047640
SMILES C1=CC2=C(C=C1Br)C=C(C(=O)O2)C(=O)O
IUPAC Name 6-bromo-2-oxochromene-3-carboxylic acid
InChI Key XFQHPAXNKDYMOX-UHFFFAOYSA-N
Molecular Formula C10H5BrO4
668

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
669

3-Acetylcoumarin 98.0+%, TCI America™

CAS: 3949-36-8 Molecular Formula: C11H8O3 Molecular Weight (g/mol): 188.182 MDL Number: MFCD00006853 InChI Key: CSPIFKKOBWYOEX-UHFFFAOYSA-N Synonym: 3-acetylcoumarin,3-acetyl-2h-chromen-2-one,coumarin, 3-acetyl,2h-1-benzopyran-2-one, 3-acetyl,3-acetyl-2-oxochromene,3-acetylcoumarine,pubchem8664,maybridge1_000885,prestwick0_000891,prestwick1_000891 PubChem CID: 77553 IUPAC Name: 3-acetylchromen-2-one SMILES: CC(=O)C1=CC2=CC=CC=C2OC1=O

PubChem CID 77553
CAS 3949-36-8
Molecular Weight (g/mol) 188.182
MDL Number MFCD00006853
SMILES CC(=O)C1=CC2=CC=CC=C2OC1=O
Synonym 3-acetylcoumarin,3-acetyl-2h-chromen-2-one,coumarin, 3-acetyl,2h-1-benzopyran-2-one, 3-acetyl,3-acetyl-2-oxochromene,3-acetylcoumarine,pubchem8664,maybridge1_000885,prestwick0_000891,prestwick1_000891
IUPAC Name 3-acetylchromen-2-one
InChI Key CSPIFKKOBWYOEX-UHFFFAOYSA-N
Molecular Formula C11H8O3
670

Coumarin-3-carbonitrile 98.0+%, TCI America™

CAS: 15119-34-3 Molecular Formula: C10H5NO2 Molecular Weight (g/mol): 171.16 MDL Number: MFCD00115699 InChI Key: QKJALQPLNMEDAV-UHFFFAOYSA-N Synonym: 3-cyanocoumarin,2-oxo-2h-chromene-3-carbonitrile,coumarin-3-carbonitrile,2h-1-benzopyran-3-carbonitrile, 2-oxo,2-oxo-2h-1-benzopyran-3-carbonitrile,coumarin, 3-cyano-7ci,8ci,3-cyano-coumarin,pubchem8675,acmc-1cfdq PubChem CID: 203763 IUPAC Name: 2-oxo-2H-chromene-3-carbonitrile SMILES: O=C1OC2=CC=CC=C2C=C1C#N

PubChem CID 203763
CAS 15119-34-3
Molecular Weight (g/mol) 171.16
MDL Number MFCD00115699
SMILES O=C1OC2=CC=CC=C2C=C1C#N
Synonym 3-cyanocoumarin,2-oxo-2h-chromene-3-carbonitrile,coumarin-3-carbonitrile,2h-1-benzopyran-3-carbonitrile, 2-oxo,2-oxo-2h-1-benzopyran-3-carbonitrile,coumarin, 3-cyano-7ci,8ci,3-cyano-coumarin,pubchem8675,acmc-1cfdq
IUPAC Name 2-oxo-2H-chromene-3-carbonitrile
InChI Key QKJALQPLNMEDAV-UHFFFAOYSA-N
Molecular Formula C10H5NO2
671

Ethyl 7-Hydroxycoumarin-3-carboxylate 98.0+%, TCI America™

CAS: 6093-71-6 Molecular Formula: C12H10O5 Molecular Weight (g/mol): 234.207 MDL Number: MFCD00017641 InChI Key: IETDBZQIWIJQJG-UHFFFAOYSA-N Synonym: 7-Hydroxycoumarin-3-carboxylic Acid Ethyl Ester, Ethyl Umbelliferone-3-carboxylate, Umbelliferone-3-carboxylic Acid Ethyl Ester PubChem CID: 5289613 IUPAC Name: ethyl 7-hydroxy-2-oxochromene-3-carboxylate SMILES: CCOC(=O)C1=CC2=C(C=C(C=C2)O)OC1=O

PubChem CID 5289613
CAS 6093-71-6
Molecular Weight (g/mol) 234.207
MDL Number MFCD00017641
SMILES CCOC(=O)C1=CC2=C(C=C(C=C2)O)OC1=O
Synonym 7-Hydroxycoumarin-3-carboxylic Acid Ethyl Ester, Ethyl Umbelliferone-3-carboxylate, Umbelliferone-3-carboxylic Acid Ethyl Ester
IUPAC Name ethyl 7-hydroxy-2-oxochromene-3-carboxylate
InChI Key IETDBZQIWIJQJG-UHFFFAOYSA-N
Molecular Formula C12H10O5
672

3-(2-Benzothiazolyl)-7-(diethylamino)coumarin 98.0+%, TCI America™

CAS: 38215-36-0 Molecular Formula: C20H18N2O2S Molecular Weight (g/mol): 350.436 MDL Number: MFCD00041869 InChI Key: VBVAVBCYMYWNOU-UHFFFAOYSA-N Synonym: coumarin 6,3-2-benzothiazolyl-7-diethylamino coumarin,2h-1-benzopyran-2-one, 3-2-benzothiazolyl-7-diethylamino,3-benzo d thiazol-2-yl-7-diethylamino-2h-chromen-2-one,3-1,3-benzothiazol-2-yl-7-diethylamino-2h-chromen-2-one,3-1,3-benzothiazol-2-yl-7-diethylamino chromen-2-one,3-2-benzthiazolyl-7-diethylaminocoumarin,3-2-benzothiazolyl-n,n-diethylumbelliferylamine,3-benzothiazol-2-yl-7-diethylamino chromen-2-one,coumarin-6 PubChem CID: 100334 ChEBI: CHEBI:51942 IUPAC Name: 3-(1,3-benzothiazol-2-yl)-7-(diethylamino)chromen-2-one SMILES: CCN(CC)C1=CC2=C(C=C1)C=C(C(=O)O2)C3=NC4=CC=CC=C4S3

PubChem CID 100334
CAS 38215-36-0
Molecular Weight (g/mol) 350.436
ChEBI CHEBI:51942
MDL Number MFCD00041869
SMILES CCN(CC)C1=CC2=C(C=C1)C=C(C(=O)O2)C3=NC4=CC=CC=C4S3
Synonym coumarin 6,3-2-benzothiazolyl-7-diethylamino coumarin,2h-1-benzopyran-2-one, 3-2-benzothiazolyl-7-diethylamino,3-benzo d thiazol-2-yl-7-diethylamino-2h-chromen-2-one,3-1,3-benzothiazol-2-yl-7-diethylamino-2h-chromen-2-one,3-1,3-benzothiazol-2-yl-7-diethylamino chromen-2-one,3-2-benzthiazolyl-7-diethylaminocoumarin,3-2-benzothiazolyl-n,n-diethylumbelliferylamine,3-benzothiazol-2-yl-7-diethylamino chromen-2-one,coumarin-6
IUPAC Name 3-(1,3-benzothiazol-2-yl)-7-(diethylamino)chromen-2-one
InChI Key VBVAVBCYMYWNOU-UHFFFAOYSA-N
Molecular Formula C20H18N2O2S
673

4-Methylumbelliferone 98.0+%, TCI America™

CAS: 90-33-5 Molecular Formula: C10H8O3 Molecular Weight (g/mol): 176.17 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-methyl-2H-chromen-2-one SMILES: CC1=CC(=O)OC2=CC(O)=CC=C12

PubChem CID 5280567
CAS 90-33-5
Molecular Weight (g/mol) 176.17
ChEBI CHEBI:17224
MDL Number MFCD00006866
SMILES CC1=CC(=O)OC2=CC(O)=CC=C12
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
IUPAC Name 7-hydroxy-4-methyl-2H-chromen-2-one
InChI Key HSHNITRMYYLLCV-UHFFFAOYSA-N
Molecular Formula C10H8O3
674

Seratrodast 98.0+%, TCI America™

CAS: 112665-43-7 Molecular Formula: C22H26O4 Molecular Weight (g/mol): 354.446 MDL Number: MFCD00875701 InChI Key: ZBVKEHDGYSLCCC-UHFFFAOYSA-N Synonym: seratrodast,bronica,abbott 73001,abbott-73001,seratrodast usan:inn,7-phenyl-7-2,4,5-trimethyl-3,6-dioxocyclohexa-1,4-dien-1-yl heptanoic acid,bronica tn,ccris 8939,+--7-3,5,6-trimethyl-1,4-benzoquinon-2-yl-7-phenylheptanoic acid,seratrodast jan/usan/inn PubChem CID: 2449 IUPAC Name: 7-phenyl-7-(2,4,5-trimethyl-3,6-dioxocyclohexa-1,4-dien-1-yl)heptanoic acid SMILES: CC1=C(C(=O)C(=C(C1=O)C)C(CCCCCC(=O)O)C2=CC=CC=C2)C

PubChem CID 2449
CAS 112665-43-7
Molecular Weight (g/mol) 354.446
MDL Number MFCD00875701
SMILES CC1=C(C(=O)C(=C(C1=O)C)C(CCCCCC(=O)O)C2=CC=CC=C2)C
Synonym seratrodast,bronica,abbott 73001,abbott-73001,seratrodast usan:inn,7-phenyl-7-2,4,5-trimethyl-3,6-dioxocyclohexa-1,4-dien-1-yl heptanoic acid,bronica tn,ccris 8939,+--7-3,5,6-trimethyl-1,4-benzoquinon-2-yl-7-phenylheptanoic acid,seratrodast jan/usan/inn
IUPAC Name 7-phenyl-7-(2,4,5-trimethyl-3,6-dioxocyclohexa-1,4-dien-1-yl)heptanoic acid
InChI Key ZBVKEHDGYSLCCC-UHFFFAOYSA-N
Molecular Formula C22H26O4
675

Myricitrin 98.0+%, TCI America™

CAS: 17912-87-7 Molecular Formula: C21H20O12 Molecular Weight (g/mol): 464.379 MDL Number: MFCD00016930 InChI Key: DCYOADKBABEMIQ-OWMUPTOHSA-N PubChem CID: 5281673 ChEBI: CHEBI:70082 IUPAC Name: 5,7-dihydroxy-3-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy-2-(3,4,5-trihydroxyphenyl)chromen-4-one SMILES: CC1C(C(C(C(O1)OC2=C(OC3=CC(=CC(=C3C2=O)O)O)C4=CC(=C(C(=C4)O)O)O)O)O)O

PubChem CID 5281673
CAS 17912-87-7
Molecular Weight (g/mol) 464.379
ChEBI CHEBI:70082
MDL Number MFCD00016930
SMILES CC1C(C(C(C(O1)OC2=C(OC3=CC(=CC(=C3C2=O)O)O)C4=CC(=C(C(=C4)O)O)O)O)O)O
IUPAC Name 5,7-dihydroxy-3-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy-2-(3,4,5-trihydroxyphenyl)chromen-4-one
InChI Key DCYOADKBABEMIQ-OWMUPTOHSA-N
Molecular Formula C21H20O12