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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)
Stilbenes (105)
Macrolide lactams (84)
Anthracyclines (73)
Macrolides and analogues (73)
Tetracyclines (63)
Cinnamyl alcohols (60)
Isocoumarins and derivatives (27)
Macrolactams (22)
Dihydrocoumarins (16)
Neoflavonoids (14)
Ochratoxins and related substances (11)
Angucyclines (1)

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691 – 705 of 3,687 results
691

6-Chloro-4-hydroxycoumarin 97.0+%, TCI America™

CAS: 19484-57-2 Molecular Formula: C9H5ClO3 Molecular Weight (g/mol): 196.59 MDL Number: MFCD00239399 InChI Key: UJHIADILZZWIED-UHFFFAOYSA-N Synonym: 6-chloro-4-hydroxycoumarin,6-chloro-4-hydroxy-2h-chromen-2-one,4-hydroxy-6-chlorocoumarin,6-chloro-4-hydroxy-2h-1-benzopyran-2-one,2h-1-benzopyran-2-one,6-chloro-4-hydroxy,6-chloro-2-hydroxychromen-4-one,6-chloro-2-hydroxy-4h-chromen-4-one,pubchem24343,acmc-1bsui,6-chlor-4-oxy-cumarin PubChem CID: 54686348 IUPAC Name: 6-chloro-2-hydroxy-4H-chromen-4-one SMILES: OC1=CC(=O)C2=CC(Cl)=CC=C2O1

PubChem CID 54686348
CAS 19484-57-2
Molecular Weight (g/mol) 196.59
MDL Number MFCD00239399
SMILES OC1=CC(=O)C2=CC(Cl)=CC=C2O1
Synonym 6-chloro-4-hydroxycoumarin,6-chloro-4-hydroxy-2h-chromen-2-one,4-hydroxy-6-chlorocoumarin,6-chloro-4-hydroxy-2h-1-benzopyran-2-one,2h-1-benzopyran-2-one,6-chloro-4-hydroxy,6-chloro-2-hydroxychromen-4-one,6-chloro-2-hydroxy-4h-chromen-4-one,pubchem24343,acmc-1bsui,6-chlor-4-oxy-cumarin
IUPAC Name 6-chloro-2-hydroxy-4H-chromen-4-one
InChI Key UJHIADILZZWIED-UHFFFAOYSA-N
Molecular Formula C9H5ClO3
692

2-Oxo-2H-chromen-7-yl Trifluoromethanesulfonate 98.0+%, TCI America™

CAS: 108530-10-5 Molecular Formula: C10H5F3O5S Molecular Weight (g/mol): 294.2 MDL Number: MFCD18382236 InChI Key: RHZZAJVDTLUWRD-UHFFFAOYSA-N Synonym: Trifluoromethanesulfonic Acid 2-Oxo-2H-chromen-7-yl Ester, 7-Coumaryl Trifluoromethanesulfonate, 7-Coumaryl Triflate PubChem CID: 13704479 IUPAC Name: (2-oxochromen-7-yl) trifluoromethanesulfonate SMILES: C1=CC(=CC2=C1C=CC(=O)O2)OS(=O)(=O)C(F)(F)F

PubChem CID 13704479
CAS 108530-10-5
Molecular Weight (g/mol) 294.2
MDL Number MFCD18382236
SMILES C1=CC(=CC2=C1C=CC(=O)O2)OS(=O)(=O)C(F)(F)F
Synonym Trifluoromethanesulfonic Acid 2-Oxo-2H-chromen-7-yl Ester, 7-Coumaryl Trifluoromethanesulfonate, 7-Coumaryl Triflate
IUPAC Name (2-oxochromen-7-yl) trifluoromethanesulfonate
InChI Key RHZZAJVDTLUWRD-UHFFFAOYSA-N
Molecular Formula C10H5F3O5S
693

N-Succinimidyl 7-Methoxycoumarin-3-carboxylate 98.0+%, TCI America™

CAS: 150321-92-9 Molecular Formula: C15H11NO7 Molecular Weight (g/mol): 317.253 MDL Number: MFCD00467593 InChI Key: JMQAALOXLOSYCQ-UHFFFAOYSA-N Synonym: 7-Methoxycoumarin-3-carboxylic Acid N-Succinimidyl Ester PubChem CID: 2760554 IUPAC Name: (2,5-dioxopyrrolidin-1-yl) 7-methoxy-2-oxochromene-3-carboxylate SMILES: COC1=CC2=C(C=C1)C=C(C(=O)O2)C(=O)ON3C(=O)CCC3=O

PubChem CID 2760554
CAS 150321-92-9
Molecular Weight (g/mol) 317.253
MDL Number MFCD00467593
SMILES COC1=CC2=C(C=C1)C=C(C(=O)O2)C(=O)ON3C(=O)CCC3=O
Synonym 7-Methoxycoumarin-3-carboxylic Acid N-Succinimidyl Ester
IUPAC Name (2,5-dioxopyrrolidin-1-yl) 7-methoxy-2-oxochromene-3-carboxylate
InChI Key JMQAALOXLOSYCQ-UHFFFAOYSA-N
Molecular Formula C15H11NO7
694

4-Hydroxycoumarin 98.0+%, TCI America™

CAS: 1076-38-6 Molecular Formula: C9H6O3 Molecular Weight (g/mol): 162.14 MDL Number: MFCD00006856 InChI Key: OWBBAPRUYLEWRR-UHFFFAOYSA-N Synonym: 4-hydroxycoumarin,4-coumarinol,4-hydroxy-2h-chromen-2-one,benzotetronic acid,coumarin, 4-hydroxy,2h-1-benzopyran-2-one, 4-hydroxy,4-hydroxy-2h-1-benzopyran-2-one,4-hydroxy-1-benzopyran-2-one,4-hydroxy-chromen-2-one,unii-x954zll2rd PubChem CID: 54682930 ChEBI: CHEBI:40070 IUPAC Name: 2-hydroxy-4H-chromen-4-one SMILES: OC1=CC(=O)C2=CC=CC=C2O1

PubChem CID 54682930
CAS 1076-38-6
Molecular Weight (g/mol) 162.14
ChEBI CHEBI:40070
MDL Number MFCD00006856
SMILES OC1=CC(=O)C2=CC=CC=C2O1
Synonym 4-hydroxycoumarin,4-coumarinol,4-hydroxy-2h-chromen-2-one,benzotetronic acid,coumarin, 4-hydroxy,2h-1-benzopyran-2-one, 4-hydroxy,4-hydroxy-2h-1-benzopyran-2-one,4-hydroxy-1-benzopyran-2-one,4-hydroxy-chromen-2-one,unii-x954zll2rd
IUPAC Name 2-hydroxy-4H-chromen-4-one
InChI Key OWBBAPRUYLEWRR-UHFFFAOYSA-N
Molecular Formula C9H6O3
695

6-Nitrocoumarin 98.0+%, TCI America™

CAS: 2725-81-7 Molecular Formula: C9H5NO4 Molecular Weight (g/mol): 191.142 MDL Number: MFCD00016973 InChI Key: RMERXEXZXIVNBF-UHFFFAOYSA-N Synonym: 6-nitrocoumarin,6-nitro-2h-chromen-2-one,6-nitro-2-benzopyrone,2h-1-benzopyran-2-one, 6-nitro,acmc-20abd6,maybridge1_002226,amtgc084,6-nitro-2h-chromen-2-one #,2h-1-benzopyran-2-one,6-nitro,6-hydroxy oxido amino-2h-chromen-2-one PubChem CID: 75944 IUPAC Name: 6-nitrochromen-2-one SMILES: C1=CC2=C(C=CC(=O)O2)C=C1[N+](=O)[O-]

PubChem CID 75944
CAS 2725-81-7
Molecular Weight (g/mol) 191.142
MDL Number MFCD00016973
SMILES C1=CC2=C(C=CC(=O)O2)C=C1[N+](=O)[O-]
Synonym 6-nitrocoumarin,6-nitro-2h-chromen-2-one,6-nitro-2-benzopyrone,2h-1-benzopyran-2-one, 6-nitro,acmc-20abd6,maybridge1_002226,amtgc084,6-nitro-2h-chromen-2-one #,2h-1-benzopyran-2-one,6-nitro,6-hydroxy oxido amino-2h-chromen-2-one
IUPAC Name 6-nitrochromen-2-one
InChI Key RMERXEXZXIVNBF-UHFFFAOYSA-N
Molecular Formula C9H5NO4
696

6-Bromo-4-hydroxycoumarin 98.0+%, TCI America™

CAS: 4139-61-1 Molecular Formula: C9H5BrO3 Molecular Weight (g/mol): 241.04 MDL Number: MFCD00239372 InChI Key: KNMCTCABMSGXGR-UHFFFAOYSA-N PubChem CID: 54691404 IUPAC Name: 6-bromo-4-hydroxychromen-2-one SMILES: C1=CC2=C(C=C1Br)C(=CC(=O)O2)O

PubChem CID 54691404
CAS 4139-61-1
Molecular Weight (g/mol) 241.04
MDL Number MFCD00239372
SMILES C1=CC2=C(C=C1Br)C(=CC(=O)O2)O
IUPAC Name 6-bromo-4-hydroxychromen-2-one
InChI Key KNMCTCABMSGXGR-UHFFFAOYSA-N
Molecular Formula C9H5BrO3
697

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
698

3,4-Dihydrocoumarin 98.0+%, TCI America™

CAS: 119-84-6 Molecular Formula: C9H8O2 Molecular Weight (g/mol): 148.161 MDL Number: MFCD00006881 InChI Key: VMUXSMXIQBNMGZ-UHFFFAOYSA-N Synonym: dihydrocoumarin,3,4-dihydrocoumarin,hydrocoumarin,chroman-2-one,benzodihydropyrone,melilotin,melilotol,2-chromanone,1,2-benzodihydropyrone,melilotic lactone PubChem CID: 660 ChEBI: CHEBI:16151 IUPAC Name: 3,4-dihydrochromen-2-one SMILES: C1CC(=O)OC2=CC=CC=C21

PubChem CID 660
CAS 119-84-6
Molecular Weight (g/mol) 148.161
ChEBI CHEBI:16151
MDL Number MFCD00006881
SMILES C1CC(=O)OC2=CC=CC=C21
Synonym dihydrocoumarin,3,4-dihydrocoumarin,hydrocoumarin,chroman-2-one,benzodihydropyrone,melilotin,melilotol,2-chromanone,1,2-benzodihydropyrone,melilotic lactone
IUPAC Name 3,4-dihydrochromen-2-one
InChI Key VMUXSMXIQBNMGZ-UHFFFAOYSA-N
Molecular Formula C9H8O2
699

2,3,4-Trimethoxycinnamic Acid 98.0+%, TCI America™

CAS: 33130-03-9 Molecular Formula: C12H14O5 Molecular Weight (g/mol): 238.239 MDL Number: MFCD00014376 InChI Key: ZYOPDNLIHHFGEC-FNORWQNLSA-N Synonym: 2,3,4-trimethoxycinnamic acid,trans-2,3,4-trimethoxycinnamic acid,3-2,3,4-trimethoxyphenyl acrylic acid,2e-3-2,3,4-trimethoxyphenyl prop-2-enoic acid,2-propenoic acid, 3-2,3,4-trimethoxyphenyl,3-2,3,4-trimethoxyphenyl propenoic acid,trans-2, 3, 4-trimethoxycinnamate,2e-3-2,3,4-trimethoxyphenyl-2-propenoic acid,e-3-2,3,4-trimethoxyphenyl acrylic acid,2e-3-2,3,4-trimethoxyphenyl acrylic acid PubChem CID: 735841 IUPAC Name: (E)-3-(2,3,4-trimethoxyphenyl)prop-2-enoic acid SMILES: COC1=C(C(=C(C=C1)C=CC(=O)O)OC)OC

PubChem CID 735841
CAS 33130-03-9
Molecular Weight (g/mol) 238.239
MDL Number MFCD00014376
SMILES COC1=C(C(=C(C=C1)C=CC(=O)O)OC)OC
Synonym 2,3,4-trimethoxycinnamic acid,trans-2,3,4-trimethoxycinnamic acid,3-2,3,4-trimethoxyphenyl acrylic acid,2e-3-2,3,4-trimethoxyphenyl prop-2-enoic acid,2-propenoic acid, 3-2,3,4-trimethoxyphenyl,3-2,3,4-trimethoxyphenyl propenoic acid,trans-2, 3, 4-trimethoxycinnamate,2e-3-2,3,4-trimethoxyphenyl-2-propenoic acid,e-3-2,3,4-trimethoxyphenyl acrylic acid,2e-3-2,3,4-trimethoxyphenyl acrylic acid
IUPAC Name (E)-3-(2,3,4-trimethoxyphenyl)prop-2-enoic acid
InChI Key ZYOPDNLIHHFGEC-FNORWQNLSA-N
Molecular Formula C12H14O5
700

4-Nitrocinnamic Acid 99.0+%, TCI America™

CAS: 619-89-6 Molecular Formula: C9H7NO4 Molecular Weight (g/mol): 193.158 MDL Number: MFCD00007381 InChI Key: XMMRNCHTDONGRJ-ZZXKWVIFSA-N Synonym: 4-nitrocinnamic acid,3-4-nitrophenyl acrylic acid,p-nitrocinnamic acid,cinnamic acid, p-nitro,2-propenoic acid, 3-4-nitrophenyl,e-3-4-nitrophenyl acrylic acid,3-4-nitrophenyl propenoic acid,trans-4-nitrocinnamic acid,ccris 1665,2e-3-4-nitrophenyl prop-2-enoic acid PubChem CID: 737157 SMILES: C1=CC(=CC=C1C=CC(=O)O)[N+](=O)[O-]

PubChem CID 737157
CAS 619-89-6
Molecular Weight (g/mol) 193.158
MDL Number MFCD00007381
SMILES C1=CC(=CC=C1C=CC(=O)O)[N+](=O)[O-]
Synonym 4-nitrocinnamic acid,3-4-nitrophenyl acrylic acid,p-nitrocinnamic acid,cinnamic acid, p-nitro,2-propenoic acid, 3-4-nitrophenyl,e-3-4-nitrophenyl acrylic acid,3-4-nitrophenyl propenoic acid,trans-4-nitrocinnamic acid,ccris 1665,2e-3-4-nitrophenyl prop-2-enoic acid
InChI Key XMMRNCHTDONGRJ-ZZXKWVIFSA-N
Molecular Formula C9H7NO4
701

alpha-Methylcinnamic Acid 98.0+%, TCI America™

CAS: 1199-77-5 Molecular Formula: C10H10O2 Molecular Weight (g/mol): 162.19 MDL Number: MFCD00002652 InChI Key: XNCRUNXWPDJHGV-BQYQJAHWSA-N Synonym: alpha-methylcinnamic acid,2-methyl-3-phenylacrylic acid,2e-2-methyl-3-phenylprop-2-enoic acid,a-methylcinnamic acid,2e-2-methyl-3-phenylacrylic acid,.alpha.-methylcinnamic acid,e-2-methyl-3-phenylacrylic acid,2-propenoic acid, 2-methyl-3-phenyl,alpha-methyl cinnamic acid,e-2-methyl-3-phenylprop-2-enoic acid PubChem CID: 637817 IUPAC Name: (2E)-2-methyl-3-phenylprop-2-enoic acid SMILES: C\C(=C/C1=CC=CC=C1)C(O)=O

PubChem CID 637817
CAS 1199-77-5
Molecular Weight (g/mol) 162.19
MDL Number MFCD00002652
SMILES C\C(=C/C1=CC=CC=C1)C(O)=O
Synonym alpha-methylcinnamic acid,2-methyl-3-phenylacrylic acid,2e-2-methyl-3-phenylprop-2-enoic acid,a-methylcinnamic acid,2e-2-methyl-3-phenylacrylic acid,.alpha.-methylcinnamic acid,e-2-methyl-3-phenylacrylic acid,2-propenoic acid, 2-methyl-3-phenyl,alpha-methyl cinnamic acid,e-2-methyl-3-phenylprop-2-enoic acid
IUPAC Name (2E)-2-methyl-3-phenylprop-2-enoic acid
InChI Key XNCRUNXWPDJHGV-BQYQJAHWSA-N
Molecular Formula C10H10O2
702

(E)-4-(4-Hydroxy-3-methoxyphenyl)-3-buten-2-one 98.0+%, TCI America™

CAS: 22214-42-2 Molecular Formula: C11H12O3 Molecular Weight (g/mol): 192.21 MDL Number: MFCD00012210 InChI Key: AFWKBSMFXWNGRE-UHFFFAOYSA-N Synonym: Dehydrozingerone, Vanillylideneacetone PubChem CID: 5354238 ChEBI: CHEBI:81361 IUPAC Name: 4-(4-hydroxy-3-methoxyphenyl)but-3-en-2-one SMILES: COC1=C(O)C=CC(C=CC(C)=O)=C1

PubChem CID 5354238
CAS 22214-42-2
Molecular Weight (g/mol) 192.21
ChEBI CHEBI:81361
MDL Number MFCD00012210
SMILES COC1=C(O)C=CC(C=CC(C)=O)=C1
Synonym Dehydrozingerone, Vanillylideneacetone
IUPAC Name 4-(4-hydroxy-3-methoxyphenyl)but-3-en-2-one
InChI Key AFWKBSMFXWNGRE-UHFFFAOYSA-N
Molecular Formula C11H12O3
703

Pentafluorophenyl Benzoate 98.0+%, TCI America™

CAS: 1548-84-1 Molecular Formula: C13H5F5O2 Molecular Weight (g/mol): 288.173 InChI Key: WZPWTXZSQHIABL-UHFFFAOYSA-N Synonym: Benzoic Acid Pentafluorophenyl Ester PubChem CID: 11011649 IUPAC Name: (2,3,4,5,6-pentafluorophenyl) benzoate SMILES: C1=CC=C(C=C1)C(=O)OC2=C(C(=C(C(=C2F)F)F)F)F

PubChem CID 11011649
CAS 1548-84-1
Molecular Weight (g/mol) 288.173
SMILES C1=CC=C(C=C1)C(=O)OC2=C(C(=C(C(=C2F)F)F)F)F
Synonym Benzoic Acid Pentafluorophenyl Ester
IUPAC Name (2,3,4,5,6-pentafluorophenyl) benzoate
InChI Key WZPWTXZSQHIABL-UHFFFAOYSA-N
Molecular Formula C13H5F5O2
704

(S)-2-Octyl 4-[4-(Hexyloxy)benzoyloxy]benzoate 98.0+%, TCI America™

CAS: 87321-20-8 Molecular Formula: C28H38O5 Molecular Weight (g/mol): 454.607 MDL Number: MFCD01941070 InChI Key: PLGPDUBTEHIWRH-QFIPXVFZSA-N Synonym: 4-[4-(Hexyloxy)benzoyloxy]benzoic Acid (S)-2-Octyl Ester PubChem CID: 22845344 IUPAC Name: [4-[(2S)-octan-2-yl]oxycarbonylphenyl] 4-hexoxybenzoate SMILES: CCCCCCC(C)OC(=O)C1=CC=C(C=C1)OC(=O)C2=CC=C(C=C2)OCCCCCC

PubChem CID 22845344
CAS 87321-20-8
Molecular Weight (g/mol) 454.607
MDL Number MFCD01941070
SMILES CCCCCCC(C)OC(=O)C1=CC=C(C=C1)OC(=O)C2=CC=C(C=C2)OCCCCCC
Synonym 4-[4-(Hexyloxy)benzoyloxy]benzoic Acid (S)-2-Octyl Ester
IUPAC Name [4-[(2S)-octan-2-yl]oxycarbonylphenyl] 4-hexoxybenzoate
InChI Key PLGPDUBTEHIWRH-QFIPXVFZSA-N
Molecular Formula C28H38O5
705

Phlorizin Hydrate 97.0+%, TCI America™

CAS: 60-81-1 Molecular Formula: C21H24O10 Molecular Weight (g/mol): 436.413 MDL Number: MFCD00006591 InChI Key: IOUVKUPGCMBWBT-QNDFHXLGSA-N Synonym: phlorizin,phloridzin,phlorhizin,phlorizoside,floridzin,phlorrhizin,phloretin 2'-glucoside,phloridzosid,phlorrhizen,phlorizine PubChem CID: 6072 ChEBI: CHEBI:8113 IUPAC Name: 1-[2,4-dihydroxy-6-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]-3-(4-hydroxyphenyl)propan-1-one SMILES: C1=CC(=CC=C1CCC(=O)C2=C(C=C(C=C2OC3C(C(C(C(O3)CO)O)O)O)O)O)O

PubChem CID 6072
CAS 60-81-1
Molecular Weight (g/mol) 436.413
ChEBI CHEBI:8113
MDL Number MFCD00006591
SMILES C1=CC(=CC=C1CCC(=O)C2=C(C=C(C=C2OC3C(C(C(C(O3)CO)O)O)O)O)O)O
Synonym phlorizin,phloridzin,phlorhizin,phlorizoside,floridzin,phlorrhizin,phloretin 2'-glucoside,phloridzosid,phlorrhizen,phlorizine
IUPAC Name 1-[2,4-dihydroxy-6-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]-3-(4-hydroxyphenyl)propan-1-one
InChI Key IOUVKUPGCMBWBT-QNDFHXLGSA-N
Molecular Formula C21H24O10