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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.
Cinnamic acids and derivatives (576)
Coumarins and derivatives (522)
Flavonoids (501)
Phenylpropanoic acids (307)
Linear 1 3-diarylpropanoids (278)
Depsides and depsidones (167)
Isoflavonoids (111)
Cinnamaldehydes (103)
Stilbenes (95)
Anthracyclines (48)
Macrolide lactams (47)
Tetracyclines (46)
Macrolides and analogues (39)
Isocoumarins and derivatives (33)
Cinnamyl alcohols (31)
Dihydrocoumarins (12)
Macrolactams (11)
Ochratoxins and related substances (11)
Neoflavonoids (5)
Angucyclines (1)

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151 – 165 of 2,212 results
151

Phloretin, 98%

CAS: 60-82-2 Molecular Formula: C15H14O5 Molecular Weight (g/mol): 274.272 MDL Number: MFCD00002288 InChI Key: VGEREEWJJVICBM-UHFFFAOYSA-N Synonym: phloretin,dihydronaringenin,3-4-hydroxyphenyl-1-2,4,6-trihydroxyphenyl propan-1-one,phloretol,3-4-hydroxyphenyl-1-2,4,6-trihydroxyphenyl-1-propanone,unii-s5j5oe47mk,1-propanone, 3-4-hydroxyphenyl-1-2,4,6-trihydroxyphenyl,ccris 7459,beta-p-hydroxyphenyl phloropropiophenone,2',4',6'-trihydroxy-3-p-hydroxyphenyl propiophenone 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

PubChem CID 4788
CAS 60-82-2
Molecular Weight (g/mol) 274.272
ChEBI CHEBI:17276
MDL Number MFCD00002288
SMILES C1=CC(=CC=C1CCC(=O)C2=C(C=C(C=C2O)O)O)O
Synonym phloretin,dihydronaringenin,3-4-hydroxyphenyl-1-2,4,6-trihydroxyphenyl propan-1-one,phloretol,3-4-hydroxyphenyl-1-2,4,6-trihydroxyphenyl-1-propanone,unii-s5j5oe47mk,1-propanone, 3-4-hydroxyphenyl-1-2,4,6-trihydroxyphenyl,ccris 7459,beta-p-hydroxyphenyl phloropropiophenone,2',4',6'-trihydroxy-3-p-hydroxyphenyl propiophenone
IUPAC Name 3-(4-hydroxyphenyl)-1-(2,4,6-trihydroxyphenyl)propan-1-one
InChI Key VGEREEWJJVICBM-UHFFFAOYSA-N
Molecular Formula C15H14O5
152

Cinnamamide, 97%, predominantly trans

CAS: 621-79-4 Molecular Formula: C9H9NO Molecular Weight (g/mol): 147.18 MDL Number: MFCD00008033 InChI Key: APEJMQOBVMLION-VOTSOKGWSA-N Synonym: cinnamamide,trans-cinnamamide,3-phenylacrylamide,cinnamic amide,2-propenamide, 3-phenyl,3-phenylpropenamide,2-benzylideneacetamide,e-cinnamamide,ginnamic acid amide,trans-cinnamoylamine PubChem CID: 5273472 ChEBI: CHEBI:76320 IUPAC Name: (E)-3-phenylprop-2-enamide SMILES: C1=CC=C(C=C1)C=CC(=O)N

PubChem CID 5273472
CAS 621-79-4
Molecular Weight (g/mol) 147.18
ChEBI CHEBI:76320
MDL Number MFCD00008033
SMILES C1=CC=C(C=C1)C=CC(=O)N
Synonym cinnamamide,trans-cinnamamide,3-phenylacrylamide,cinnamic amide,2-propenamide, 3-phenyl,3-phenylpropenamide,2-benzylideneacetamide,e-cinnamamide,ginnamic acid amide,trans-cinnamoylamine
IUPAC Name (E)-3-phenylprop-2-enamide
InChI Key APEJMQOBVMLION-VOTSOKGWSA-N
Molecular Formula C9H9NO
153

Dibenzoylmethane, 98%

CAS: 120-46-7 Molecular Formula: C15H12O2 Molecular Weight (g/mol): 224.26 MDL Number: MFCD00003085 InChI Key: NZZIMKJIVMHWJC-UHFFFAOYSA-N Synonym: dibenzoylmethane,1,3-diphenyl-1,3-propanedione,2-benzoylacetophenone,phenyl phenacyl ketone,1,3-propanedione, 1,3-diphenyl,rhodiastab 83,omega-benzoylacetophenone,dibenzoyl-methane,karenzu dk2,unii-ans7me8okc PubChem CID: 8433 ChEBI: CHEBI:75417 IUPAC Name: 1,3-diphenylpropane-1,3-dione SMILES: C1=CC=C(C=C1)C(=O)CC(=O)C2=CC=CC=C2

PubChem CID 8433
CAS 120-46-7
Molecular Weight (g/mol) 224.26
ChEBI CHEBI:75417
MDL Number MFCD00003085
SMILES C1=CC=C(C=C1)C(=O)CC(=O)C2=CC=CC=C2
Synonym dibenzoylmethane,1,3-diphenyl-1,3-propanedione,2-benzoylacetophenone,phenyl phenacyl ketone,1,3-propanedione, 1,3-diphenyl,rhodiastab 83,omega-benzoylacetophenone,dibenzoyl-methane,karenzu dk2,unii-ans7me8okc
IUPAC Name 1,3-diphenylpropane-1,3-dione
InChI Key NZZIMKJIVMHWJC-UHFFFAOYSA-N
Molecular Formula C15H12O2
154

3,3',4',7-Tetrahydroxyflavone, 96%

CAS: 528-48-3 Molecular Formula: C15H10O6 Molecular Weight (g/mol): 286.239 MDL Number: MFCD00006829 InChI Key: XHEFDIBZLJXQHF-UHFFFAOYSA-N Synonym: fisetin,viset,5-desoxyquercetin,fustel,2-3,4-dihydroxyphenyl-3,7-dihydroxy-4h-chromen-4-one,fisetholz,superfustel,cotinin,fietin,fustet PubChem CID: 5281614 ChEBI: CHEBI:42567 IUPAC Name: 2-(3,4-dihydroxyphenyl)-3,7-dihydroxychromen-4-one SMILES: C1=CC(=C(C=C1C2=C(C(=O)C3=C(O2)C=C(C=C3)O)O)O)O

PubChem CID 5281614
CAS 528-48-3
Molecular Weight (g/mol) 286.239
ChEBI CHEBI:42567
MDL Number MFCD00006829
SMILES C1=CC(=C(C=C1C2=C(C(=O)C3=C(O2)C=C(C=C3)O)O)O)O
Synonym fisetin,viset,5-desoxyquercetin,fustel,2-3,4-dihydroxyphenyl-3,7-dihydroxy-4h-chromen-4-one,fisetholz,superfustel,cotinin,fietin,fustet
IUPAC Name 2-(3,4-dihydroxyphenyl)-3,7-dihydroxychromen-4-one
InChI Key XHEFDIBZLJXQHF-UHFFFAOYSA-N
Molecular Formula C15H10O6
155

3,5,7-Trihydroxyflavone, 97%

CAS: 548-83-4 Molecular Formula: C15H10O5 Molecular Weight (g/mol): 270.24 MDL Number: MFCD00006833 InChI Key: VCCRNZQBSJXYJD-UHFFFAOYSA-N Synonym: galangin,norizalpinin,3,5,7-trihydroxyflavone,3,5,7-trihydroxy-2-phenyl-4h-chromen-4-one,3,5,7-trioh-flavone,unii-142fwe6ecs,3,5,7-trihydroxy-2-phenyl-4-benzopyrone,4h-1-benzopyran-4-one, 3,5,7-trihydroxy-2-phenyl,flavone, 3,5,7-trihydroxy,4h-benzopyran-4-one, 3,5,7-trihydroxy-2-phenyl PubChem CID: 5281616 ChEBI: CHEBI:5262 IUPAC Name: 3,5,7-trihydroxy-2-phenylchromen-4-one SMILES: C1=CC=C(C=C1)C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)O

PubChem CID 5281616
CAS 548-83-4
Molecular Weight (g/mol) 270.24
ChEBI CHEBI:5262
MDL Number MFCD00006833
SMILES C1=CC=C(C=C1)C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)O
Synonym galangin,norizalpinin,3,5,7-trihydroxyflavone,3,5,7-trihydroxy-2-phenyl-4h-chromen-4-one,3,5,7-trioh-flavone,unii-142fwe6ecs,3,5,7-trihydroxy-2-phenyl-4-benzopyrone,4h-1-benzopyran-4-one, 3,5,7-trihydroxy-2-phenyl,flavone, 3,5,7-trihydroxy,4h-benzopyran-4-one, 3,5,7-trihydroxy-2-phenyl
IUPAC Name 3,5,7-trihydroxy-2-phenylchromen-4-one
InChI Key VCCRNZQBSJXYJD-UHFFFAOYSA-N
Molecular Formula C15H10O5
156

3',5-Dihydroxy-4',6,7-trimethoxyflavone, 97%

CAS: 855-96-9 Molecular Formula: C18H16O7 Molecular Weight (g/mol): 344.319 MDL Number: MFCD00016929 InChI Key: KLAOKWJLUQKWIF-UHFFFAOYSA-N Synonym: eupatorin,3',5-dihydroxy-4',6,7-trimethoxyflavone,eupatorine,5-hydroxy-2-3-hydroxy-4-methoxyphenyl-6,7-dimethoxy-4h-chromen-4-one,unii-3j474av6my,5-hydroxy-2-3-hydroxy-4-methoxyphenyl-6,7-dimethoxy-4h-1-benzopyran-4-one,6-methoxyluteolin 4',7-dimethyl ether,5-hydroxy-2-3-hydroxy-4-methoxyphenyl-6,7-dimethoxychromen-4-one,kinome_3214,spectrum_001037 PubChem CID: 97214 IUPAC Name: 5-hydroxy-2-(3-hydroxy-4-methoxyphenyl)-6,7-dimethoxychromen-4-one SMILES: COC1=C(C=C(C=C1)C2=CC(=O)C3=C(C(=C(C=C3O2)OC)OC)O)O

PubChem CID 97214
CAS 855-96-9
Molecular Weight (g/mol) 344.319
MDL Number MFCD00016929
SMILES COC1=C(C=C(C=C1)C2=CC(=O)C3=C(C(=C(C=C3O2)OC)OC)O)O
Synonym eupatorin,3',5-dihydroxy-4',6,7-trimethoxyflavone,eupatorine,5-hydroxy-2-3-hydroxy-4-methoxyphenyl-6,7-dimethoxy-4h-chromen-4-one,unii-3j474av6my,5-hydroxy-2-3-hydroxy-4-methoxyphenyl-6,7-dimethoxy-4h-1-benzopyran-4-one,6-methoxyluteolin 4',7-dimethyl ether,5-hydroxy-2-3-hydroxy-4-methoxyphenyl-6,7-dimethoxychromen-4-one,kinome_3214,spectrum_001037
IUPAC Name 5-hydroxy-2-(3-hydroxy-4-methoxyphenyl)-6,7-dimethoxychromen-4-one
InChI Key KLAOKWJLUQKWIF-UHFFFAOYSA-N
Molecular Formula C18H16O7
157

4',5,7-Trihydroxyflavone, 97%

CAS: 520-36-5 Molecular Formula: C15H10O5 Molecular Weight (g/mol): 270.24 MDL Number: MFCD00006831 InChI Key: KZNIFHPLKGYRTM-UHFFFAOYSA-N Synonym: apigenin,5,7-dihydroxy-2-4-hydroxyphenyl-4h-chromen-4-one,chamomile,spigenin,versulin,apigenol,4',5,7-trihydroxyflavone,apigenine,c.i. natural yellow 1,5,7,4'-trihydroxyflavone PubChem CID: 5280443 ChEBI: CHEBI:18388 IUPAC Name: 5,7-dihydroxy-2-(4-hydroxyphenyl)chromen-4-one SMILES: OC1=CC=C(C=C1)C1=CC(=O)C2=C(O)C=C(O)C=C2O1

PubChem CID 5280443
CAS 520-36-5
Molecular Weight (g/mol) 270.24
ChEBI CHEBI:18388
MDL Number MFCD00006831
SMILES OC1=CC=C(C=C1)C1=CC(=O)C2=C(O)C=C(O)C=C2O1
Synonym apigenin,5,7-dihydroxy-2-4-hydroxyphenyl-4h-chromen-4-one,chamomile,spigenin,versulin,apigenol,4',5,7-trihydroxyflavone,apigenine,c.i. natural yellow 1,5,7,4'-trihydroxyflavone
IUPAC Name 5,7-dihydroxy-2-(4-hydroxyphenyl)chromen-4-one
InChI Key KZNIFHPLKGYRTM-UHFFFAOYSA-N
Molecular Formula C15H10O5
158

p-Methoxycinnamic acid, 98%, predominantly trans

CAS: 830-09-1 Molecular Formula: C10H10O3 Molecular Weight (g/mol): 178.19 MDL Number: MFCD00004398 InChI Key: AFDXODALSZRGIH-QPJJXVBHSA-N Synonym: 4-methoxycinnamic acid,p-methoxycinnamic acid,3-4-methoxyphenyl acrylic acid,trans-4-methoxycinnamic acid,4-methoxycinnamate,para-methoxycinnamic acid,o-methyl-p-coumaric acid,cinnamic acid, p-methoxy,e-3-4-methoxyphenyl acrylic acid,e-3-4-methoxyphenyl-2-propenoic acid PubChem CID: 699414 IUPAC Name: (E)-3-(4-methoxyphenyl)prop-2-enoic acid SMILES: COC1=CC=C(C=C1)C=CC(=O)O

PubChem CID 699414
CAS 830-09-1
Molecular Weight (g/mol) 178.19
MDL Number MFCD00004398
SMILES COC1=CC=C(C=C1)C=CC(=O)O
Synonym 4-methoxycinnamic acid,p-methoxycinnamic acid,3-4-methoxyphenyl acrylic acid,trans-4-methoxycinnamic acid,4-methoxycinnamate,para-methoxycinnamic acid,o-methyl-p-coumaric acid,cinnamic acid, p-methoxy,e-3-4-methoxyphenyl acrylic acid,e-3-4-methoxyphenyl-2-propenoic acid
IUPAC Name (E)-3-(4-methoxyphenyl)prop-2-enoic acid
InChI Key AFDXODALSZRGIH-QPJJXVBHSA-N
Molecular Formula C10H10O3
159

(+/-)-Equol, Thermo Scientific Chemicals

CAS: 94105-90-5 Molecular Formula: C15H14O3 Molecular Weight (g/mol): 242.27 MDL Number: MFCD00016662 InChI Key: ADFCQWZHKCXPAJ-UHFFFAOYNA-N Synonym: 3-4-hydroxyphenyl chroman-7-ol,equol,+/--equol,r,s-equol,7,4'-homoisoflavane,4',7-dihydroxyisoflavane,rs-equol,3-4-hydroxyphenyl-7-chromanol,2h-1-benzopyran-7-ol, 3,4-dihydro-3-4-hydroxyphenyl,4',7-isoflavandiol PubChem CID: 382975 IUPAC Name: 3-(4-hydroxyphenyl)-3,4-dihydro-2H-chromen-7-ol SMILES: OC1=CC=C(C=C1)C1COC2=C(C1)C=CC(O)=C2

PubChem CID 382975
CAS 94105-90-5
Molecular Weight (g/mol) 242.27
MDL Number MFCD00016662
SMILES OC1=CC=C(C=C1)C1COC2=C(C1)C=CC(O)=C2
Synonym 3-4-hydroxyphenyl chroman-7-ol,equol,+/--equol,r,s-equol,7,4'-homoisoflavane,4',7-dihydroxyisoflavane,rs-equol,3-4-hydroxyphenyl-7-chromanol,2h-1-benzopyran-7-ol, 3,4-dihydro-3-4-hydroxyphenyl,4',7-isoflavandiol
IUPAC Name 3-(4-hydroxyphenyl)-3,4-dihydro-2H-chromen-7-ol
InChI Key ADFCQWZHKCXPAJ-UHFFFAOYNA-N
Molecular Formula C15H14O3
160

(-)-Epigallocatechin

CAS: 970-74-1 Molecular Formula: C15H14O7 Molecular Weight (g/mol): 306.27 MDL Number: MFCD00075939 InChI Key: XMOCLSLCDHWDHP-IUODEOHRSA-N Synonym: --epigallocatechin,epigallocatechin,epigallocatechol,l-epigallocatechin,epi-gallocatechin,antiscurvy factor c2,--epigallocatechol,l-epigallocatechol,--3,3',4',5,5',7-flavanhexol,3,3',4',5,5',7-flavanhexol PubChem CID: 72277 ChEBI: CHEBI:42255 IUPAC Name: (2R,3R)-2-(3,4,5-trihydroxyphenyl)-3,4-dihydro-2H-chromene-3,5,7-triol SMILES: C1C(C(OC2=CC(=CC(=C21)O)O)C3=CC(=C(C(=C3)O)O)O)O

PubChem CID 72277
CAS 970-74-1
Molecular Weight (g/mol) 306.27
ChEBI CHEBI:42255
MDL Number MFCD00075939
SMILES C1C(C(OC2=CC(=CC(=C21)O)O)C3=CC(=C(C(=C3)O)O)O)O
Synonym --epigallocatechin,epigallocatechin,epigallocatechol,l-epigallocatechin,epi-gallocatechin,antiscurvy factor c2,--epigallocatechol,l-epigallocatechol,--3,3',4',5,5',7-flavanhexol,3,3',4',5,5',7-flavanhexol
IUPAC Name (2R,3R)-2-(3,4,5-trihydroxyphenyl)-3,4-dihydro-2H-chromene-3,5,7-triol
InChI Key XMOCLSLCDHWDHP-IUODEOHRSA-N
Molecular Formula C15H14O7
161

7-Methoxycoumarin-4-acetic acid

CAS: 62935-72-2 Molecular Formula: C12H10O5 Molecular Weight (g/mol): 234.21 MDL Number: MFCD00009774 InChI Key: ZEKAXIFHLIITGV-UHFFFAOYSA-N Synonym: 7-methoxycoumarin-4-acetic acid,2-7-methoxy-2-oxo-2h-chromen-4-yl acetic acid,7-methoxy-2-oxo-2h-chromen-4-yl acetic acid,7-methoxy-2-oxo-2h-1-benzopyran-4-acetic acid,2h-1-benzopyran-4-acetic acid, 7-methoxy-2-oxo,2-7-methoxy-2-oxochromen-4-yl acetic acid,7-methoxy-2-oxo-2h-chromen-4-yl-acetic acid,7-methoxycoumarin-4-yl acetic acid,7-methoxy-2-oxochromen-4-yl acetic acid,mca-oh PubChem CID: 342221 ChEBI: CHEBI:51666 IUPAC Name: 2-(7-methoxy-2-oxochromen-4-yl)acetic acid SMILES: COC1=CC=C2C(CC(O)=O)=CC(=O)OC2=C1

PubChem CID 342221
CAS 62935-72-2
Molecular Weight (g/mol) 234.21
ChEBI CHEBI:51666
MDL Number MFCD00009774
SMILES COC1=CC=C2C(CC(O)=O)=CC(=O)OC2=C1
Synonym 7-methoxycoumarin-4-acetic acid,2-7-methoxy-2-oxo-2h-chromen-4-yl acetic acid,7-methoxy-2-oxo-2h-chromen-4-yl acetic acid,7-methoxy-2-oxo-2h-1-benzopyran-4-acetic acid,2h-1-benzopyran-4-acetic acid, 7-methoxy-2-oxo,2-7-methoxy-2-oxochromen-4-yl acetic acid,7-methoxy-2-oxo-2h-chromen-4-yl-acetic acid,7-methoxycoumarin-4-yl acetic acid,7-methoxy-2-oxochromen-4-yl acetic acid,mca-oh
IUPAC Name 2-(7-methoxy-2-oxochromen-4-yl)acetic acid
InChI Key ZEKAXIFHLIITGV-UHFFFAOYSA-N
Molecular Formula C12H10O5
162

Neohesperidin dihydrochalcone hydrate, 98+%

CAS: 20702-77-6 Molecular Formula: C28H36O15 Molecular Weight (g/mol): 612.58 MDL Number: MFCD00017711 InChI Key: ITVGXXMINPYUHD-UHFFFAOYSA-N Synonym: neohesperidin dihydrochalcone,nhdc,neohesperidin dc,neohesperidin dhc,unii-3x476d83qv,ccris 4848,neosperidin dihydrochalcone,neohesperidine dihydrochalcone,1-4-2-o-6-deoxy-alpha-l-mannopyranosyl-beta-d-glucopyranosyl oxy-2,6-dihydroxyphenyl-3-3-hydroxy-4-methoxyphenyl propan-1-one,1-4-2-o-6-deoxy-alpha-l-mannopyranosyl-beta-d-glucopyranosyl oxy-2,6-dihydroxyphenyl-3-3-hydroxy-4-methoxyphenyl PubChem CID: 30231 ChEBI: CHEBI:83535 IUPAC Name: 1-[4-[(2S,3R,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxy-2,6-dihydroxyphenyl]-3-(3-hydroxy-4-methoxyphenyl)propan-1-one SMILES: COC1=C(O)C=C(CCC(=O)C2=C(O)C=C(OC3OC(CO)C(O)C(O)C3OC3OC(C)C(O)C(O)C3O)C=C2O)C=C1

PubChem CID 30231
CAS 20702-77-6
Molecular Weight (g/mol) 612.58
ChEBI CHEBI:83535
MDL Number MFCD00017711
SMILES COC1=C(O)C=C(CCC(=O)C2=C(O)C=C(OC3OC(CO)C(O)C(O)C3OC3OC(C)C(O)C(O)C3O)C=C2O)C=C1
Synonym neohesperidin dihydrochalcone,nhdc,neohesperidin dc,neohesperidin dhc,unii-3x476d83qv,ccris 4848,neosperidin dihydrochalcone,neohesperidine dihydrochalcone,1-4-2-o-6-deoxy-alpha-l-mannopyranosyl-beta-d-glucopyranosyl oxy-2,6-dihydroxyphenyl-3-3-hydroxy-4-methoxyphenyl propan-1-one,1-4-2-o-6-deoxy-alpha-l-mannopyranosyl-beta-d-glucopyranosyl oxy-2,6-dihydroxyphenyl-3-3-hydroxy-4-methoxyphenyl
IUPAC Name 1-[4-[(2S,3R,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxy-2,6-dihydroxyphenyl]-3-(3-hydroxy-4-methoxyphenyl)propan-1-one
InChI Key ITVGXXMINPYUHD-UHFFFAOYSA-N
Molecular Formula C28H36O15
163

(-)-Gallocatechin

CAS: 3371-27-5 Molecular Formula: C15H14O7 Molecular Weight (g/mol): 306.27 MDL Number: MFCD01632616 InChI Key: XMOCLSLCDHWDHP-DOMZBBRYSA-N Synonym: --gallocatechin,2s,3r-2-3,4,5-trihydroxyphenyl chroman-3,5,7-triol,2s,3r-gallocatechin,ent-gallocatechin,2s,3r-flavan-3,3',4',5,5',7-hexol,2s,3r-flavan-3,5,7,3',4',5'-hexol,2s,3r-2-3,4,5-trihydroxyphenyl-3,4-dihydro-2h-chromene-3,5,7-triol,2s,3r---2-3,4,5-trihydroxyphenyl-3,4-dihydro-2h-chromene-3,5,7-triol,gallocatechingc,l-gallocatechin PubChem CID: 9882981 ChEBI: CHEBI:71225 IUPAC Name: (2S,3R)-2-(3,4,5-trihydroxyphenyl)-3,4-dihydro-2H-chromene-3,5,7-triol SMILES: C1C(C(OC2=CC(=CC(=C21)O)O)C3=CC(=C(C(=C3)O)O)O)O

PubChem CID 9882981
CAS 3371-27-5
Molecular Weight (g/mol) 306.27
ChEBI CHEBI:71225
MDL Number MFCD01632616
SMILES C1C(C(OC2=CC(=CC(=C21)O)O)C3=CC(=C(C(=C3)O)O)O)O
Synonym --gallocatechin,2s,3r-2-3,4,5-trihydroxyphenyl chroman-3,5,7-triol,2s,3r-gallocatechin,ent-gallocatechin,2s,3r-flavan-3,3',4',5,5',7-hexol,2s,3r-flavan-3,5,7,3',4',5'-hexol,2s,3r-2-3,4,5-trihydroxyphenyl-3,4-dihydro-2h-chromene-3,5,7-triol,2s,3r---2-3,4,5-trihydroxyphenyl-3,4-dihydro-2h-chromene-3,5,7-triol,gallocatechingc,l-gallocatechin
IUPAC Name (2S,3R)-2-(3,4,5-trihydroxyphenyl)-3,4-dihydro-2H-chromene-3,5,7-triol
InChI Key XMOCLSLCDHWDHP-DOMZBBRYSA-N
Molecular Formula C15H14O7
164

2-[4-(Bromomethyl)phenyl]propionic acid, 96%

CAS: 111128-12-2 Molecular Formula: C10H11BrO2 Molecular Weight (g/mol): 243.1 MDL Number: MFCD02093445 InChI Key: QQXBRVQJMKBAOZ-UHFFFAOYSA-N Synonym: 2-4-bromomethyl phenyl propanoic acid,2-4-bromomethyl phenyl propionic acid,2-4-bromomethyl phenylpropionic acid,2-4-bromomethyl-phenyl-propionic acid,4-bromomethyl hydratropic acid,2-4-bromomethyl phenyl propanic acid,2-p-bromomethyl phenyl propionic acid,2-4'-bromomethylphenyl propionic acid,2-4-bromomethyl phenylproplonic acid PubChem CID: 2733978 IUPAC Name: 2-[4-(bromomethyl)phenyl]propanoic acid SMILES: CC(C1=CC=C(C=C1)CBr)C(=O)O

PubChem CID 2733978
CAS 111128-12-2
Molecular Weight (g/mol) 243.1
MDL Number MFCD02093445
SMILES CC(C1=CC=C(C=C1)CBr)C(=O)O
Synonym 2-4-bromomethyl phenyl propanoic acid,2-4-bromomethyl phenyl propionic acid,2-4-bromomethyl phenylpropionic acid,2-4-bromomethyl-phenyl-propionic acid,4-bromomethyl hydratropic acid,2-4-bromomethyl phenyl propanic acid,2-p-bromomethyl phenyl propionic acid,2-4'-bromomethylphenyl propionic acid,2-4-bromomethyl phenylproplonic acid
IUPAC Name 2-[4-(bromomethyl)phenyl]propanoic acid
InChI Key QQXBRVQJMKBAOZ-UHFFFAOYSA-N
Molecular Formula C10H11BrO2
165

4',5,7-Trihydroxyisoflavone, 99+%

CAS: 446-72-0 Molecular Formula: C15H10O5 Molecular Weight (g/mol): 270.24 MDL Number: MFCD00016952 InChI Key: TZBJGXHYKVUXJN-UHFFFAOYSA-N Synonym: genistein,prunetol,genisteol,4',5,7-trihydroxyisoflavone,genisterin,sophoricol,5,7,4'-trihydroxyisoflavone,bonistein,5,7-dihydroxy-3-4-hydroxyphenyl-4h-chromen-4-one,genestein PubChem CID: 5280961 ChEBI: CHEBI:28088 IUPAC Name: 5,7-dihydroxy-3-(4-hydroxyphenyl)chromen-4-one SMILES: OC1=CC=C(C=C1)C1=COC2=CC(O)=CC(O)=C2C1=O

PubChem CID 5280961
CAS 446-72-0
Molecular Weight (g/mol) 270.24
ChEBI CHEBI:28088
MDL Number MFCD00016952
SMILES OC1=CC=C(C=C1)C1=COC2=CC(O)=CC(O)=C2C1=O
Synonym genistein,prunetol,genisteol,4',5,7-trihydroxyisoflavone,genisterin,sophoricol,5,7,4'-trihydroxyisoflavone,bonistein,5,7-dihydroxy-3-4-hydroxyphenyl-4h-chromen-4-one,genestein
IUPAC Name 5,7-dihydroxy-3-(4-hydroxyphenyl)chromen-4-one
InChI Key TZBJGXHYKVUXJN-UHFFFAOYSA-N
Molecular Formula C15H10O5