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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 (867)
Cinnamic acids and derivatives (860)
Coumarins and derivatives (675)
Linear 1 3-diarylpropanoids (466)
Phenylpropanoic acids (332)
Depsides and depsidones (299)
Isoflavonoids (200)
Cinnamaldehydes (119)
Stilbenes (105)
Macrolide lactams (81)
Macrolides and analogues (73)
Anthracyclines (69)
Cinnamyl alcohols (60)
Tetracyclines (60)
Isocoumarins and derivatives (27)
Macrolactams (22)
Dihydrocoumarins (16)
Neoflavonoids (14)
Ochratoxins and related substances (11)
Angucyclines (1)

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286 – 300 of 3,622 results
286

Pentafluorophenyl 4-(tetrahydropyran-4-yloxy)benzoate, 97%, Thermo Scientific™

CAS: 930110-97-7 Molecular Formula: C18H13F5O4 Molecular Weight (g/mol): 388.29 MDL Number: MFCD09702368 InChI Key: BDWCEFHYQPZQRO-UHFFFAOYSA-N Synonym: pentafluorophenyl 4-tetrahydropyran-4-yloxy benzoate,pentafluorophenyl 4-oxan-4-yloxy benzoate,pentafluorophenyl 4-oxan-4-yl oxy benzoate,2,3,4,5,6-pentafluorophenyl 4-oxan-4-yloxy benzoate,2,3,4,5,6-pentakis fluoranyl phenyl 4-oxan-4-yloxy benzoate,4-4-oxanyloxy benzoic acid 2,3,4,5,6-pentafluorophenyl ester PubChem CID: 24229528 IUPAC Name: (2,3,4,5,6-pentafluorophenyl) 4-(oxan-4-yloxy)benzoate SMILES: FC1=C(F)C(F)=C(OC(=O)C2=CC=C(OC3CCOCC3)C=C2)C(F)=C1F

PubChem CID 24229528
CAS 930110-97-7
Molecular Weight (g/mol) 388.29
MDL Number MFCD09702368
SMILES FC1=C(F)C(F)=C(OC(=O)C2=CC=C(OC3CCOCC3)C=C2)C(F)=C1F
Synonym pentafluorophenyl 4-tetrahydropyran-4-yloxy benzoate,pentafluorophenyl 4-oxan-4-yloxy benzoate,pentafluorophenyl 4-oxan-4-yl oxy benzoate,2,3,4,5,6-pentafluorophenyl 4-oxan-4-yloxy benzoate,2,3,4,5,6-pentakis fluoranyl phenyl 4-oxan-4-yloxy benzoate,4-4-oxanyloxy benzoic acid 2,3,4,5,6-pentafluorophenyl ester
IUPAC Name (2,3,4,5,6-pentafluorophenyl) 4-(oxan-4-yloxy)benzoate
InChI Key BDWCEFHYQPZQRO-UHFFFAOYSA-N
Molecular Formula C18H13F5O4
287

Salicylsalicylic acid, 98%

CAS: 552-94-3 Molecular Formula: C14H10O5 Molecular Weight (g/mol): 258.22 MDL Number: MFCD00020252 InChI Key: WVYADZUPLLSGPU-UHFFFAOYSA-N Synonym: salsalate,sasapyrine,salicylsalicylic acid,disalicylic acid,disalcid,sasapyrinum,saloxium,2-carboxyphenyl salicylate,salina,diacesal PubChem CID: 5161 ChEBI: CHEBI:9014 IUPAC Name: 2-(2-hydroxybenzoyl)oxybenzoic acid SMILES: C1=CC=C(C(=C1)C(=O)OC2=CC=CC=C2C(=O)O)O

PubChem CID 5161
CAS 552-94-3
Molecular Weight (g/mol) 258.22
ChEBI CHEBI:9014
MDL Number MFCD00020252
SMILES C1=CC=C(C(=C1)C(=O)OC2=CC=CC=C2C(=O)O)O
Synonym salsalate,sasapyrine,salicylsalicylic acid,disalicylic acid,disalcid,sasapyrinum,saloxium,2-carboxyphenyl salicylate,salina,diacesal
IUPAC Name 2-(2-hydroxybenzoyl)oxybenzoic acid
InChI Key WVYADZUPLLSGPU-UHFFFAOYSA-N
Molecular Formula C14H10O5
289

Pentafluorophenyl 3-(pyrid-2-yloxy)benzoate, 97%, Thermo Scientific™

CAS: 921938-61-6 Molecular Formula: C18H8F5NO3 Molecular Weight (g/mol): 381.258 MDL Number: MFCD09064956 InChI Key: LKCOLTBNDUOLEF-UHFFFAOYSA-N Synonym: pentafluorophenyl 3-pyrid-2-yloxy benzoate,pentafluorophenyl 3-pyridin-2-yloxy benzoate,pentafluorophenyl 3-pyridin-2-yl oxy benzoate,2,3,4,5,6-pentafluorophenyl 3-pyridin-2-yloxy benzoate,2,3,4,5,6-pentakis fluoranyl phenyl 3-pyridin-2-yloxybenzoate,3-2-pyridinyloxy benzoic acid 2,3,4,5,6-pentafluorophenyl ester PubChem CID: 24229506 IUPAC Name: (2,3,4,5,6-pentafluorophenyl) 3-pyridin-2-yloxybenzoate SMILES: C1=CC=NC(=C1)OC2=CC=CC(=C2)C(=O)OC3=C(C(=C(C(=C3F)F)F)F)F

PubChem CID 24229506
CAS 921938-61-6
Molecular Weight (g/mol) 381.258
MDL Number MFCD09064956
SMILES C1=CC=NC(=C1)OC2=CC=CC(=C2)C(=O)OC3=C(C(=C(C(=C3F)F)F)F)F
Synonym pentafluorophenyl 3-pyrid-2-yloxy benzoate,pentafluorophenyl 3-pyridin-2-yloxy benzoate,pentafluorophenyl 3-pyridin-2-yl oxy benzoate,2,3,4,5,6-pentafluorophenyl 3-pyridin-2-yloxy benzoate,2,3,4,5,6-pentakis fluoranyl phenyl 3-pyridin-2-yloxybenzoate,3-2-pyridinyloxy benzoic acid 2,3,4,5,6-pentafluorophenyl ester
IUPAC Name (2,3,4,5,6-pentafluorophenyl) 3-pyridin-2-yloxybenzoate
InChI Key LKCOLTBNDUOLEF-UHFFFAOYSA-N
Molecular Formula C18H8F5NO3
290

Curcumin, Spectrum™ Chemical
SDP

CAS: 458-37-7

CAS 458-37-7
291

trans-3-Bromocinnamic acid, 98+%

CAS: 14473-91-7 Molecular Formula: C9H7BrO2 Molecular Weight (g/mol): 227.06 MDL Number: MFCD00004382 InChI Key: YEMUSDCFQUBPAL-SNAWJCMRSA-N Synonym: 3-bromocinnamic acid,3-3-bromophenyl acrylic acid,m-bromocinnamic acid,trans-3-bromocinnamic acid,cinnamic acid, m-bromo,bw a800u,e-3-3-bromophenyl acrylic acid,3-3-bromophenyl-2-propenoic acid,2e-3-3-bromophenyl acrylic acid,bromocinnamic acid,3 PubChem CID: 776461 IUPAC Name: (E)-3-(3-bromophenyl)prop-2-enoic acid SMILES: OC(=O)\C=C\C1=CC=CC(Br)=C1

PubChem CID 776461
CAS 14473-91-7
Molecular Weight (g/mol) 227.06
MDL Number MFCD00004382
SMILES OC(=O)\C=C\C1=CC=CC(Br)=C1
Synonym 3-bromocinnamic acid,3-3-bromophenyl acrylic acid,m-bromocinnamic acid,trans-3-bromocinnamic acid,cinnamic acid, m-bromo,bw a800u,e-3-3-bromophenyl acrylic acid,3-3-bromophenyl-2-propenoic acid,2e-3-3-bromophenyl acrylic acid,bromocinnamic acid,3
IUPAC Name (E)-3-(3-bromophenyl)prop-2-enoic acid
InChI Key YEMUSDCFQUBPAL-SNAWJCMRSA-N
Molecular Formula C9H7BrO2
292

3-(2-Chloro-3,4-dimethoxyphenyl)acrylic acid, 97%, Thermo Scientific™

CAS: 99854-17-8 Molecular Formula: C11H10ClO4 Molecular Weight (g/mol): 241.65 MDL Number: MFCD00084947 InChI Key: JIPTVEJKXDVECY-GQCTYLIASA-M Synonym: 3-2-chloro-3,4-dimethoxyphenyl acrylic acid,2-chloro-3,4-dimethoxycinnamic acid,2e-3-2-chloro-3,4-dimethoxyphenyl prop-2-enoic acid,e-3-2-chloro-3,4-dimethoxyphenyl acrylic acid,e-3-2-chloro-3,4-dimethoxy-phenyl-acrylic acid,e-3-2-chloro-3,4-dimethoxyphenyl prop-2-enoic acid,2e-3-2-chloro-3,4-dimethoxyphenyl-2-propenoic acid PubChem CID: 5708524 IUPAC Name: (E)-3-(2-chloro-3,4-dimethoxyphenyl)prop-2-enoic acid SMILES: COC1=CC=C(\C=C\C([O-])=O)C(Cl)=C1OC

PubChem CID 5708524
CAS 99854-17-8
Molecular Weight (g/mol) 241.65
MDL Number MFCD00084947
SMILES COC1=CC=C(\C=C\C([O-])=O)C(Cl)=C1OC
Synonym 3-2-chloro-3,4-dimethoxyphenyl acrylic acid,2-chloro-3,4-dimethoxycinnamic acid,2e-3-2-chloro-3,4-dimethoxyphenyl prop-2-enoic acid,e-3-2-chloro-3,4-dimethoxyphenyl acrylic acid,e-3-2-chloro-3,4-dimethoxy-phenyl-acrylic acid,e-3-2-chloro-3,4-dimethoxyphenyl prop-2-enoic acid,2e-3-2-chloro-3,4-dimethoxyphenyl-2-propenoic acid
IUPAC Name (E)-3-(2-chloro-3,4-dimethoxyphenyl)prop-2-enoic acid
InChI Key JIPTVEJKXDVECY-GQCTYLIASA-M
Molecular Formula C11H10ClO4
293

4-Bromocinnamic acid, predominantly trans, 97+%

CAS: 1200-07-3 Molecular Formula: C9H7BrO2 Molecular Weight (g/mol): 227.06 MDL Number: MFCD00004394 InChI Key: CPDDDTNAMBSPRN-ZZXKWVIFSA-N Synonym: 4-bromocinnamic acid,p-bromocinnamic acid,3-4-bromophenyl acrylic acid,bromocinnamic acid,4,2e-3-4-bromophenyl prop-2-enoic acid,trans-4-bromocinnamic acid,e-3-4-bromophenyl acrylic acid,2-propenoic acid, 3-4-bromophenyl-, 2e,4-bromocinnamic acid, predominantly trans,rarechem bk hd c006 PubChem CID: 737158 IUPAC Name: (E)-3-(4-bromophenyl)prop-2-enoic acid SMILES: OC(=O)\C=C\C1=CC=C(Br)C=C1

PubChem CID 737158
CAS 1200-07-3
Molecular Weight (g/mol) 227.06
MDL Number MFCD00004394
SMILES OC(=O)\C=C\C1=CC=C(Br)C=C1
Synonym 4-bromocinnamic acid,p-bromocinnamic acid,3-4-bromophenyl acrylic acid,bromocinnamic acid,4,2e-3-4-bromophenyl prop-2-enoic acid,trans-4-bromocinnamic acid,e-3-4-bromophenyl acrylic acid,2-propenoic acid, 3-4-bromophenyl-, 2e,4-bromocinnamic acid, predominantly trans,rarechem bk hd c006
IUPAC Name (E)-3-(4-bromophenyl)prop-2-enoic acid
InChI Key CPDDDTNAMBSPRN-ZZXKWVIFSA-N
Molecular Formula C9H7BrO2
294

Doxorubicin hydrochloride, MP Biomedicals™

CAS: 25316-40-9 Molecular Formula: C27H30ClNO11 Molecular Weight (g/mol): 579.98 MDL Number: MFCD00077757,MFCD00077757,MFCD00941448 InChI Key: MWWSFMDVAYGXBV-FGBJBKNOSA-N Synonym: doxorubicin hydrochloride,adriamycin,doxorubicin hcl,adriacin,adriblastina,rubex,adriamycin hydrochloride,adriblastin,adriamycin pfs PubChem CID: 129626538 IUPAC Name: hydrogen (8S,10S)-10-[(4-amino-5-hydroxy-6-methyloxan-2-yl)oxy]-6,8,11-trihydroxy-8-(2-hydroxyacetyl)-1-methoxy-5,7,8,9,10,12-hexahydrotetracene-5,12-dione chloride SMILES: [H+].[Cl-].COC1=CC=CC2=C1C(=O)C1=C(O)C3=C(C[C@](O)(C[C@@H]3OC3CC(N)C(O)C(C)O3)C(=O)CO)C(O)=C1C2=O

PubChem CID 129626538
CAS 25316-40-9
Molecular Weight (g/mol) 579.98
MDL Number MFCD00077757,MFCD00077757,MFCD00941448
SMILES [H+].[Cl-].COC1=CC=CC2=C1C(=O)C1=C(O)C3=C(C[C@](O)(C[C@@H]3OC3CC(N)C(O)C(C)O3)C(=O)CO)C(O)=C1C2=O
Synonym doxorubicin hydrochloride,adriamycin,doxorubicin hcl,adriacin,adriblastina,rubex,adriamycin hydrochloride,adriblastin,adriamycin pfs
IUPAC Name hydrogen (8S,10S)-10-[(4-amino-5-hydroxy-6-methyloxan-2-yl)oxy]-6,8,11-trihydroxy-8-(2-hydroxyacetyl)-1-methoxy-5,7,8,9,10,12-hexahydrotetracene-5,12-dione chloride
InChI Key MWWSFMDVAYGXBV-FGBJBKNOSA-N
Molecular Formula C27H30ClNO11
295

Daunorubicin hydrochloride

CAS: 23541-50-6 Molecular Formula: C27H30ClNO10 Molecular Weight (g/mol): 563.984 MDL Number: MFCD04974507 InChI Key: GUGHGUXZJWAIAS-QQYBVWGSSA-N Synonym: daunorubicin hydrochloride,daunorubicin hcl,daunomycin hydrochloride,daunoblastina,rubidomycin hydrochloride,daunorubicinol hydrochloride,daunoblastin,rubomycin,ondena,daunomycin chlorohydrate PubChem CID: 62770 IUPAC Name: (7S,9S)-9-acetyl-7-[(2R,4S,5S,6S)-4-amino-5-hydroxy-6-methyloxan-2-yl]oxy-6,9,11-trihydroxy-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)C)O)N)O.Cl

PubChem CID 62770
CAS 23541-50-6
Molecular Weight (g/mol) 563.984
MDL Number MFCD04974507
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)C)O)N)O.Cl
Synonym daunorubicin hydrochloride,daunorubicin hcl,daunomycin hydrochloride,daunoblastina,rubidomycin hydrochloride,daunorubicinol hydrochloride,daunoblastin,rubomycin,ondena,daunomycin chlorohydrate
IUPAC Name (7S,9S)-9-acetyl-7-[(2R,4S,5S,6S)-4-amino-5-hydroxy-6-methyloxan-2-yl]oxy-6,9,11-trihydroxy-4-methoxy-8,10-dihydro-7H-tetracene-5,12-dione;hydrochloride
InChI Key GUGHGUXZJWAIAS-QQYBVWGSSA-N
Molecular Formula C27H30ClNO10
296

3,4-Dichloroisocoumarin, 98%

CAS: 51050-59-0 Molecular Formula: C9H4Cl2O2 Molecular Weight (g/mol): 215.03 MDL Number: MFCD00036960 InChI Key: SUGXUUGGLDCZKB-UHFFFAOYSA-N Synonym: 3,4-dichloroisocoumarin,3,4-dcl,1h-2-benzopyran-1-one,3,4-dichloro,3,4-dci,3,4 dichloroisocoumarin,3,4-dichloro-1h-isochromen-1-one,3,4-dichloro-1h-2-benzopyran-1-one,1h-2-benzopyran-1-one, 3,4-dichloro,chembl24983,3,4-dichloro-2-benzopyran-1-one PubChem CID: 1609 IUPAC Name: 3,4-dichloroisochromen-1-one SMILES: ClC1=C(Cl)C2=CC=CC=C2C(=O)O1

PubChem CID 1609
CAS 51050-59-0
Molecular Weight (g/mol) 215.03
MDL Number MFCD00036960
SMILES ClC1=C(Cl)C2=CC=CC=C2C(=O)O1
Synonym 3,4-dichloroisocoumarin,3,4-dcl,1h-2-benzopyran-1-one,3,4-dichloro,3,4-dci,3,4 dichloroisocoumarin,3,4-dichloro-1h-isochromen-1-one,3,4-dichloro-1h-2-benzopyran-1-one,1h-2-benzopyran-1-one, 3,4-dichloro,chembl24983,3,4-dichloro-2-benzopyran-1-one
IUPAC Name 3,4-dichloroisochromen-1-one
InChI Key SUGXUUGGLDCZKB-UHFFFAOYSA-N
Molecular Formula C9H4Cl2O2
297

1,3-Diphenyl-1-butanone, 95%, Thermo Scientific Chemicals

CAS: 1533-20-6 Molecular Formula: C16H16O Molecular Weight (g/mol): 224.303 MDL Number: MFCD00026345 InChI Key: GIVFXLVPKFXTCU-UHFFFAOYSA-N Synonym: 1,3-diphenyl-1-butanone,3-phenylbutyrophenone,b-phenylbutyrophenone,acmc-20ap3x,1,3-diphenyl-butan-1-one,phenyl 2-phenylpropyl ketone,1-butanone, 1,3-diphenyl,2-alpha-methylbenzyl acetophenone PubChem CID: 137065 IUPAC Name: 1,3-diphenylbutan-1-one SMILES: CC(CC(=O)C1=CC=CC=C1)C2=CC=CC=C2

PubChem CID 137065
CAS 1533-20-6
Molecular Weight (g/mol) 224.303
MDL Number MFCD00026345
SMILES CC(CC(=O)C1=CC=CC=C1)C2=CC=CC=C2
Synonym 1,3-diphenyl-1-butanone,3-phenylbutyrophenone,b-phenylbutyrophenone,acmc-20ap3x,1,3-diphenyl-butan-1-one,phenyl 2-phenylpropyl ketone,1-butanone, 1,3-diphenyl,2-alpha-methylbenzyl acetophenone
IUPAC Name 1,3-diphenylbutan-1-one
InChI Key GIVFXLVPKFXTCU-UHFFFAOYSA-N
Molecular Formula C16H16O
298

1,3-Diphenyl-2-propyn-1-ol, tech. 90%

CAS: 1817-49-8 Molecular Formula: C15H12O Molecular Weight (g/mol): 208.26 MDL Number: MFCD06654198 InChI Key: DZZWMODRWHHWFR-UHFFFAOYSA-N Synonym: 1,3-diphenyl-2-propyn-1-ol,1,3-diphenyl-prop-2-yn-1-ol,1-phenyl-3-phenyl-propyn-3-ol,1,3-diphenylpropargyl alcohol,benzenemethanol, a-2-phenylethynyl,alpha-phenyl ethynyl-benzenemethanol PubChem CID: 296659 IUPAC Name: 1,3-diphenylprop-2-yn-1-ol SMILES: C1=CC=C(C=C1)C#CC(C2=CC=CC=C2)O

PubChem CID 296659
CAS 1817-49-8
Molecular Weight (g/mol) 208.26
MDL Number MFCD06654198
SMILES C1=CC=C(C=C1)C#CC(C2=CC=CC=C2)O
Synonym 1,3-diphenyl-2-propyn-1-ol,1,3-diphenyl-prop-2-yn-1-ol,1-phenyl-3-phenyl-propyn-3-ol,1,3-diphenylpropargyl alcohol,benzenemethanol, a-2-phenylethynyl,alpha-phenyl ethynyl-benzenemethanol
IUPAC Name 1,3-diphenylprop-2-yn-1-ol
InChI Key DZZWMODRWHHWFR-UHFFFAOYSA-N
Molecular Formula C15H12O
299

2,3-Dibromo-3-phenylpropiophenone, 98%, Thermo Scientific™

CAS: 611-91-6 Molecular Formula: C15H12Br2O Molecular Weight (g/mol): 368.07 MDL Number: MFCD00017861 InChI Key: LYAGBKGGYRLVTR-UHFFFAOYNA-N PubChem CID: 95342 IUPAC Name: 2,3-dibromo-1,3-diphenylpropan-1-one SMILES: BrC(C(Br)C1=CC=CC=C1)C(=O)C1=CC=CC=C1

PubChem CID 95342
CAS 611-91-6
Molecular Weight (g/mol) 368.07
MDL Number MFCD00017861
SMILES BrC(C(Br)C1=CC=CC=C1)C(=O)C1=CC=CC=C1
IUPAC Name 2,3-dibromo-1,3-diphenylpropan-1-one
InChI Key LYAGBKGGYRLVTR-UHFFFAOYNA-N
Molecular Formula C15H12Br2O
300

Wax Paraffin, White, Cake, Spectrum™ Chemical
SDP

CAS: 8002-74-2 Molecular Formula: C21H27NO3 Molecular Weight (g/mol): 341.45 InChI Key: JWHAUXFOSRPERK-UHFFFAOYNA-N IUPAC Name: 1-{2-[2-hydroxy-3-(propylamino)propoxy]phenyl}-3-phenylpropan-1-one SMILES: CCCNCC(O)COC1=CC=CC=C1C(=O)CCC1=CC=CC=C1

CAS 8002-74-2
Molecular Weight (g/mol) 341.45
SMILES CCCNCC(O)COC1=CC=CC=C1C(=O)CCC1=CC=CC=C1
IUPAC Name 1-{2-[2-hydroxy-3-(propylamino)propoxy]phenyl}-3-phenylpropan-1-one
InChI Key JWHAUXFOSRPERK-UHFFFAOYNA-N
Molecular Formula C21H27NO3