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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 (932)
Flavonoids (926)
Linear 1 3-diarylpropanoids (801)
Coumarins and derivatives (713)
Depsides and depsidones (520)
Phenylpropanoic acids (347)
Isoflavonoids (220)
Cinnamaldehydes (131)
Stilbenes (111)
Macrolide lactams (93)
Anthracyclines (89)
Macrolides and analogues (74)
Tetracyclines (63)
Cinnamyl alcohols (60)
Isocoumarins and derivatives (30)
Macrolactams (24)
Dihydrocoumarins (16)
Neoflavonoids (14)
Ochratoxins and related substances (11)
Angucyclines (1)

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136 – 150 of 4,444 results
136

2'-Amino-3'-methoxyflavone, 99%

CAS: 167869-21-8 Molecular Formula: C16H13NO3 Molecular Weight (g/mol): 267.28 MDL Number: MFCD00671789 InChI Key: QFWCYNPOPKQOKV-UHFFFAOYSA-N Synonym: 2-2-amino-3-methoxyphenyl-4h-chromen-4-one,2-2-amino-3-methoxyphenyl-4h-1-benzopyran-4-one,2-2-amino-3-methoxyphenyl chromen-4-one,2'-amino-3'-methoxyflavone,unii-sje1io5e3i,sje1io5e3i,chembl35482,2-2-amino-3-methoxyphenyl-chromen-4-one,4h-1-benzopyran-4-one, 2-2-amino-3-methoxyphenyl,2′-amino-3′-methoxyflavone PubChem CID: 4713 ChEBI: CHEBI:77954 IUPAC Name: 2-(2-amino-3-methoxyphenyl)chromen-4-one SMILES: COC1=CC=CC(=C1N)C1=CC(=O)C2=CC=CC=C2O1

PubChem CID 4713
CAS 167869-21-8
Molecular Weight (g/mol) 267.28
ChEBI CHEBI:77954
MDL Number MFCD00671789
SMILES COC1=CC=CC(=C1N)C1=CC(=O)C2=CC=CC=C2O1
Synonym 2-2-amino-3-methoxyphenyl-4h-chromen-4-one,2-2-amino-3-methoxyphenyl-4h-1-benzopyran-4-one,2-2-amino-3-methoxyphenyl chromen-4-one,2'-amino-3'-methoxyflavone,unii-sje1io5e3i,sje1io5e3i,chembl35482,2-2-amino-3-methoxyphenyl-chromen-4-one,4h-1-benzopyran-4-one, 2-2-amino-3-methoxyphenyl,2′-amino-3′-methoxyflavone
IUPAC Name 2-(2-amino-3-methoxyphenyl)chromen-4-one
InChI Key QFWCYNPOPKQOKV-UHFFFAOYSA-N
Molecular Formula C16H13NO3
137
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4',5-Dihydroxy-7-methoxyflavone, 97%

CAS: 437-64-9 Molecular Formula: C16H12O5 Molecular Weight (g/mol): 284.267 MDL Number: MFCD00017452 InChI Key: JPMYFOBNRRGFNO-UHFFFAOYSA-N Synonym: genkwanin,gengkwanin,4',5-dihydroxy-7-methoxyflavone,5,4'-dihydroxy-7-methoxyflavone,7-o-methylapigenin,7-methylapigenin,apigenin 7-methyl ether,puddumetin,gonkwanin,unii-5k3i5d6b2b PubChem CID: 5281617 ChEBI: CHEBI:75718 IUPAC Name: 5-hydroxy-2-(4-hydroxyphenyl)-7-methoxychromen-4-one SMILES: COC1=CC(=C2C(=C1)OC(=CC2=O)C3=CC=C(C=C3)O)O

PubChem CID 5281617
CAS 437-64-9
Molecular Weight (g/mol) 284.267
ChEBI CHEBI:75718
MDL Number MFCD00017452
SMILES COC1=CC(=C2C(=C1)OC(=CC2=O)C3=CC=C(C=C3)O)O
Synonym genkwanin,gengkwanin,4',5-dihydroxy-7-methoxyflavone,5,4'-dihydroxy-7-methoxyflavone,7-o-methylapigenin,7-methylapigenin,apigenin 7-methyl ether,puddumetin,gonkwanin,unii-5k3i5d6b2b
IUPAC Name 5-hydroxy-2-(4-hydroxyphenyl)-7-methoxychromen-4-one
InChI Key JPMYFOBNRRGFNO-UHFFFAOYSA-N
Molecular Formula C16H12O5
138
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4',5,7-Trihydroxyflavanone, 97%

CAS: 67604-48-2 Molecular Formula: C15H12O5 Molecular Weight (g/mol): 272.256 MDL Number: MFCD00006844 InChI Key: FTVWIRXFELQLPI-UHFFFAOYSA-N Synonym: naringenin,5,7-dihydroxy-2-4-hydroxyphenyl chroman-4-one,naringenine,4',5,7-trihydroxyflavanone,+/--naringenin,naringetol,salipurpol,--naringenin,narigenin,salipurol PubChem CID: 932 ChEBI: CHEBI:50202 IUPAC Name: 5,7-dihydroxy-2-(4-hydroxyphenyl)-2,3-dihydrochromen-4-one SMILES: C1C(OC2=CC(=CC(=C2C1=O)O)O)C3=CC=C(C=C3)O

PubChem CID 932
CAS 67604-48-2
Molecular Weight (g/mol) 272.256
ChEBI CHEBI:50202
MDL Number MFCD00006844
SMILES C1C(OC2=CC(=CC(=C2C1=O)O)O)C3=CC=C(C=C3)O
Synonym naringenin,5,7-dihydroxy-2-4-hydroxyphenyl chroman-4-one,naringenine,4',5,7-trihydroxyflavanone,+/--naringenin,naringetol,salipurpol,--naringenin,narigenin,salipurol
IUPAC Name 5,7-dihydroxy-2-(4-hydroxyphenyl)-2,3-dihydrochromen-4-one
InChI Key FTVWIRXFELQLPI-UHFFFAOYSA-N
Molecular Formula C15H12O5
139

5,7-Dihydroxyflavone, 98%

CAS: 480-40-0 Molecular Formula: C15H10O4 Molecular Weight (g/mol): 254.241 MDL Number: MFCD00006834 InChI Key: RTIXKCRFFJGDFG-UHFFFAOYSA-N Synonym: chrysin,5,7-dihydroxyflavone,chrysine,5,7-dihydroxy-2-phenyl-4h-chromen-4-one,crysin,4h-1-benzopyran-4-one, 5,7-dihydroxy-2-phenyl,unii-3cn01f5zj5,flavone, 5,7-dihydroxy,5,7-dihydroxy-2-phenyl-4h-1-benzopyran-4-one,chembl117 PubChem CID: 5281607 ChEBI: CHEBI:75095 IUPAC Name: 5,7-dihydroxy-2-phenylchromen-4-one SMILES: C1=CC=C(C=C1)C2=CC(=O)C3=C(C=C(C=C3O2)O)O

PubChem CID 5281607
CAS 480-40-0
Molecular Weight (g/mol) 254.241
ChEBI CHEBI:75095
MDL Number MFCD00006834
SMILES C1=CC=C(C=C1)C2=CC(=O)C3=C(C=C(C=C3O2)O)O
Synonym chrysin,5,7-dihydroxyflavone,chrysine,5,7-dihydroxy-2-phenyl-4h-chromen-4-one,crysin,4h-1-benzopyran-4-one, 5,7-dihydroxy-2-phenyl,unii-3cn01f5zj5,flavone, 5,7-dihydroxy,5,7-dihydroxy-2-phenyl-4h-1-benzopyran-4-one,chembl117
IUPAC Name 5,7-dihydroxy-2-phenylchromen-4-one
InChI Key RTIXKCRFFJGDFG-UHFFFAOYSA-N
Molecular Formula C15H10O4
140
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α-Bromocinnamaldehyde, 98%, Thermo Scientific™

CAS: 5443-49-2 InChI Key: WQRWNOKNRHCLHV-TWGQIWQCSA-N Synonym: alpha-bromocinnamaldehyde,2-bromo-3-phenylacrylaldehyde,alphabrocine,2-bromo-3-phenyl-2-propenal,bromocinnamal,alpha-bromocinnamic aldehyde,ccris 3924,b 37 van,2-propenal, 2-bromo-3-phenyl,cinnamaldehyde, alpha-bromo PubChem CID: 5369403 IUPAC Name: (Z)-2-bromo-3-phenylprop-2-enal SMILES: C1=CC=C(C=C1)C=C(C=O)Br

PubChem CID 5369403
CAS 5443-49-2
SMILES C1=CC=C(C=C1)C=C(C=O)Br
Synonym alpha-bromocinnamaldehyde,2-bromo-3-phenylacrylaldehyde,alphabrocine,2-bromo-3-phenyl-2-propenal,bromocinnamal,alpha-bromocinnamic aldehyde,ccris 3924,b 37 van,2-propenal, 2-bromo-3-phenyl,cinnamaldehyde, alpha-bromo
IUPAC Name (Z)-2-bromo-3-phenylprop-2-enal
InChI Key WQRWNOKNRHCLHV-TWGQIWQCSA-N
141
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alpha-Bromocinnamaldehyde, 98%

CAS: 5443-49-2 Molecular Formula: C9H7BrO Molecular Weight (g/mol): 211.058 MDL Number: MFCD00006965 InChI Key: WQRWNOKNRHCLHV-TWGQIWQCSA-N Synonym: alpha-bromocinnamaldehyde,2-bromo-3-phenylacrylaldehyde,alphabrocine,2-bromo-3-phenyl-2-propenal,bromocinnamal,alpha-bromocinnamic aldehyde,ccris 3924,b 37 van,2-propenal, 2-bromo-3-phenyl,cinnamaldehyde, alpha-bromo PubChem CID: 5369403 IUPAC Name: (Z)-2-bromo-3-phenylprop-2-enal SMILES: C1=CC=C(C=C1)C=C(C=O)Br

PubChem CID 5369403
CAS 5443-49-2
Molecular Weight (g/mol) 211.058
MDL Number MFCD00006965
SMILES C1=CC=C(C=C1)C=C(C=O)Br
Synonym alpha-bromocinnamaldehyde,2-bromo-3-phenylacrylaldehyde,alphabrocine,2-bromo-3-phenyl-2-propenal,bromocinnamal,alpha-bromocinnamic aldehyde,ccris 3924,b 37 van,2-propenal, 2-bromo-3-phenyl,cinnamaldehyde, alpha-bromo
IUPAC Name (Z)-2-bromo-3-phenylprop-2-enal
InChI Key WQRWNOKNRHCLHV-TWGQIWQCSA-N
Molecular Formula C9H7BrO
142

Cinnamic Aldehyde, 99%, MP Biomedicals

CAS: 104-55-2 Molecular Formula: C9H8O Molecular Weight (g/mol): 132.162 InChI Key: KJPRLNWUNMBNBZ-QPJJXVBHSA-N Synonym: cinnamaldehyde,trans-cinnamaldehyde,cinnamic aldehyde,e-cinnamaldehyde,cinnamal,3-phenylacrylaldehyde,zimtaldehyde,cinnamylaldehyde,3-phenylpropenal,2e-3-phenylprop-2-enal PubChem CID: 637511 ChEBI: CHEBI:16731 IUPAC Name: (E)-3-phenylprop-2-enal SMILES: C1=CC=C(C=C1)C=CC=O

PubChem CID 637511
CAS 104-55-2
Molecular Weight (g/mol) 132.162
ChEBI CHEBI:16731
SMILES C1=CC=C(C=C1)C=CC=O
Synonym cinnamaldehyde,trans-cinnamaldehyde,cinnamic aldehyde,e-cinnamaldehyde,cinnamal,3-phenylacrylaldehyde,zimtaldehyde,cinnamylaldehyde,3-phenylpropenal,2e-3-phenylprop-2-enal
IUPAC Name (E)-3-phenylprop-2-enal
InChI Key KJPRLNWUNMBNBZ-QPJJXVBHSA-N
Molecular Formula C9H8O
143
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D-(+)-3-Phenyllactic acid, 98%

CAS: 7326-19-4 Molecular Formula: C9H10O3 Molecular Weight (g/mol): 166.18 MDL Number: MFCD00078062 InChI Key: VOXXWSYKYCBWHO-MRVPVSSYSA-N Synonym: r-2-hydroxy-3-phenylpropionic acid,r-2-hydroxy-3-phenylpropanoic acid,2r-2-hydroxy-3-phenylpropanoic acid,d-+-phenyllactic acid,d-+-3-phenyllactic acid,r-phenyllactate,r-+-3-phenyllactic acid,3-phenyl-d-lactic acid,r-3-phenyllactic acid,r-,a-hydroxy-3-phenylpropionic acid PubChem CID: 643327 ChEBI: CHEBI:32978 IUPAC Name: (2R)-2-hydroxy-3-phenylpropanoic acid SMILES: O[C@H](CC1=CC=CC=C1)C(O)=O

PubChem CID 643327
CAS 7326-19-4
Molecular Weight (g/mol) 166.18
ChEBI CHEBI:32978
MDL Number MFCD00078062
SMILES O[C@H](CC1=CC=CC=C1)C(O)=O
Synonym r-2-hydroxy-3-phenylpropionic acid,r-2-hydroxy-3-phenylpropanoic acid,2r-2-hydroxy-3-phenylpropanoic acid,d-+-phenyllactic acid,d-+-3-phenyllactic acid,r-phenyllactate,r-+-3-phenyllactic acid,3-phenyl-d-lactic acid,r-3-phenyllactic acid,r-,a-hydroxy-3-phenylpropionic acid
IUPAC Name (2R)-2-hydroxy-3-phenylpropanoic acid
InChI Key VOXXWSYKYCBWHO-MRVPVSSYSA-N
Molecular Formula C9H10O3
144
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4-(Trifluoromethyl)hydrocinnamic acid, 95%

CAS: 53473-36-2 Molecular Formula: C10H9F3O2 Molecular Weight (g/mol): 218.17 MDL Number: MFCD00674032 InChI Key: OEIUMLSCWINLBB-UHFFFAOYSA-N Synonym: 4-trifluoromethyl hydrocinnamic acid,3-4-trifluoromethyl phenyl propanoic acid,3-4-trifluoromethyl phenyl propionic acid,benzenepropanoic acid, 4-trifluoromethyl,3-4-trifluoromethylphenyl propionic acid,4-trifluoromethyl phenylpropionic acid,p-trifluoromethyl benzylacetic acid,3-4-trifluoromethyl-phenyl-propionic acid PubChem CID: 3588736 IUPAC Name: 3-[4-(trifluoromethyl)phenyl]propanoic acid SMILES: C1=CC(=CC=C1CCC(=O)O)C(F)(F)F

PubChem CID 3588736
CAS 53473-36-2
Molecular Weight (g/mol) 218.17
MDL Number MFCD00674032
SMILES C1=CC(=CC=C1CCC(=O)O)C(F)(F)F
Synonym 4-trifluoromethyl hydrocinnamic acid,3-4-trifluoromethyl phenyl propanoic acid,3-4-trifluoromethyl phenyl propionic acid,benzenepropanoic acid, 4-trifluoromethyl,3-4-trifluoromethylphenyl propionic acid,4-trifluoromethyl phenylpropionic acid,p-trifluoromethyl benzylacetic acid,3-4-trifluoromethyl-phenyl-propionic acid
IUPAC Name 3-[4-(trifluoromethyl)phenyl]propanoic acid
InChI Key OEIUMLSCWINLBB-UHFFFAOYSA-N
Molecular Formula C10H9F3O2
145
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3-(2,6-Dichlorophenyl)propionic acid, 96%

CAS: 51656-68-9 Molecular Formula: C9H8Cl2O2 Molecular Weight (g/mol): 219.061 MDL Number: MFCD01310807 InChI Key: IDEOVPXKPDUXTP-UHFFFAOYSA-N PubChem CID: 2758192 IUPAC Name: 3-(2,6-dichlorophenyl)propanoic acid SMILES: C1=CC(=C(C(=C1)Cl)CCC(=O)O)Cl

PubChem CID 2758192
CAS 51656-68-9
Molecular Weight (g/mol) 219.061
MDL Number MFCD01310807
SMILES C1=CC(=C(C(=C1)Cl)CCC(=O)O)Cl
IUPAC Name 3-(2,6-dichlorophenyl)propanoic acid
InChI Key IDEOVPXKPDUXTP-UHFFFAOYSA-N
Molecular Formula C9H8Cl2O2
146
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3-(2-Chlorophenyl)propionic acid, 98+%

CAS: 1643-28-3 Molecular Formula: C9H9ClO2 Molecular Weight (g/mol): 184.619 MDL Number: MFCD00016547 InChI Key: KZMDFTFGWIVSNQ-UHFFFAOYSA-N Synonym: 3-2-chlorophenyl propionic acid,3-2-chlorophenyl propanoic acid,benzenepropanoic acid, 2-chloro,2-chlorobenzenepropanoic acid,2-chloro-benzenepropanoic acid,zlchem 694,pubchem19768,acmc-209dqy,2-chlorohydrocinnamic acid,ksc494i2t PubChem CID: 95676 IUPAC Name: 3-(2-chlorophenyl)propanoic acid SMILES: C1=CC=C(C(=C1)CCC(=O)O)Cl

PubChem CID 95676
CAS 1643-28-3
Molecular Weight (g/mol) 184.619
MDL Number MFCD00016547
SMILES C1=CC=C(C(=C1)CCC(=O)O)Cl
Synonym 3-2-chlorophenyl propionic acid,3-2-chlorophenyl propanoic acid,benzenepropanoic acid, 2-chloro,2-chlorobenzenepropanoic acid,2-chloro-benzenepropanoic acid,zlchem 694,pubchem19768,acmc-209dqy,2-chlorohydrocinnamic acid,ksc494i2t
IUPAC Name 3-(2-chlorophenyl)propanoic acid
InChI Key KZMDFTFGWIVSNQ-UHFFFAOYSA-N
Molecular Formula C9H9ClO2
147
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3-(4-Chlorosulfonylphenyl)propionic acid, 99%

CAS: 63545-54-0 Molecular Formula: C9H9ClO4S Molecular Weight (g/mol): 248.68 MDL Number: MFCD02179510 InChI Key: INJMPXHPNFJMLG-UHFFFAOYSA-N Synonym: 3-4-chlorosulfonyl phenyl propanoic acid,benzenepropanoicacid, 4-chlorosulfonyl,3-4-chlorosulphonyl phenyl propanoic acid,3-4-chlorosulfonylphenyl propionic acid,3-4-chlorosulfonylphenyl propanoic acid,p-chlorosylphonyldihydrocinnamic acid,4-chlorosulfonyl benzenepropanoic acid,4-chlorosulphonyl dihydrocinnamic acid,p-chlorosulphonyldihydrocinnamic acid PubChem CID: 2757915 IUPAC Name: 3-[4-(chlorosulfonyl)phenyl]propanoic acid SMILES: OC(=O)CCC1=CC=C(C=C1)S(Cl)(=O)=O

PubChem CID 2757915
CAS 63545-54-0
Molecular Weight (g/mol) 248.68
MDL Number MFCD02179510
SMILES OC(=O)CCC1=CC=C(C=C1)S(Cl)(=O)=O
Synonym 3-4-chlorosulfonyl phenyl propanoic acid,benzenepropanoicacid, 4-chlorosulfonyl,3-4-chlorosulphonyl phenyl propanoic acid,3-4-chlorosulfonylphenyl propionic acid,3-4-chlorosulfonylphenyl propanoic acid,p-chlorosylphonyldihydrocinnamic acid,4-chlorosulfonyl benzenepropanoic acid,4-chlorosulphonyl dihydrocinnamic acid,p-chlorosulphonyldihydrocinnamic acid
IUPAC Name 3-[4-(chlorosulfonyl)phenyl]propanoic acid
InChI Key INJMPXHPNFJMLG-UHFFFAOYSA-N
Molecular Formula C9H9ClO4S
148
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3-(Boc-amino)-3-phenylpropionic acid, 97%

CAS: 14676-01-8 Molecular Formula: C14H19NO4 Molecular Weight (g/mol): 265.309 MDL Number: MFCD02090695 InChI Key: JTNQFJPZRTURSI-UHFFFAOYSA-N Synonym: 3-boc-amino-3-phenylpropionic acid,3-n-boc-3-phenylpropionic acid,boc-dl-beta-phe-oh,3-tert-butoxycarbonyl amino-3-phenylpropanoic acid,3-boc-amino-3-phenyl-propionic acid,3-tert-butoxycarbonylamino-3-phenylpropanoic acid,3-tert-butoxy carbonyl amino-3-phenylpropanoic acid,boc-d-,a-phe-oh,pubchem16181 PubChem CID: 2756815 IUPAC Name: 3-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenylpropanoic acid SMILES: CC(C)(C)OC(=O)NC(CC(=O)O)C1=CC=CC=C1

PubChem CID 2756815
CAS 14676-01-8
Molecular Weight (g/mol) 265.309
MDL Number MFCD02090695
SMILES CC(C)(C)OC(=O)NC(CC(=O)O)C1=CC=CC=C1
Synonym 3-boc-amino-3-phenylpropionic acid,3-n-boc-3-phenylpropionic acid,boc-dl-beta-phe-oh,3-tert-butoxycarbonyl amino-3-phenylpropanoic acid,3-boc-amino-3-phenyl-propionic acid,3-tert-butoxycarbonylamino-3-phenylpropanoic acid,3-tert-butoxy carbonyl amino-3-phenylpropanoic acid,boc-d-,a-phe-oh,pubchem16181
IUPAC Name 3-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenylpropanoic acid
InChI Key JTNQFJPZRTURSI-UHFFFAOYSA-N
Molecular Formula C14H19NO4
149
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3-(2,5-Dimethoxyphenyl)propionic acid, 96%

CAS: 10538-49-5 Molecular Formula: C11H14O4 Molecular Weight (g/mol): 210.23 MDL Number: MFCD00060325 InChI Key: JENQUCZZZGYHRW-UHFFFAOYSA-N PubChem CID: 66343 IUPAC Name: 3-(2,5-dimethoxyphenyl)propanoic acid SMILES: COC1=CC=C(OC)C(CCC(O)=O)=C1

PubChem CID 66343
CAS 10538-49-5
Molecular Weight (g/mol) 210.23
MDL Number MFCD00060325
SMILES COC1=CC=C(OC)C(CCC(O)=O)=C1
IUPAC Name 3-(2,5-dimethoxyphenyl)propanoic acid
InChI Key JENQUCZZZGYHRW-UHFFFAOYSA-N
Molecular Formula C11H14O4
150
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L-(-)-3-Phenyllactic acid, 98%

CAS: 20312-36-1 Molecular Formula: C9H9O3 Molecular Weight (g/mol): 165.17 MDL Number: MFCD00004244 InChI Key: VOXXWSYKYCBWHO-QMMMGPOBSA-M Synonym: l---3-phenyllactic acid,s-2-hydroxy-3-phenylpropionic acid,s-2-hydroxy-3-phenylpropanoic acid,l--3-phenyllactic acid,s---3-phenyllactic acid,l-3-phenyllactic acid,d-3-phenyllactic acid,2s-2-hydroxy-3-phenylpropanoic acid,s-3-phenyllactic acid,s---2-hydroxy-3-phenylpropionic acid PubChem CID: 444718 ChEBI: CHEBI:43065 IUPAC Name: (2S)-2-hydroxy-3-phenylpropanoic acid SMILES: O[C@@H](CC1=CC=CC=C1)C([O-])=O

PubChem CID 444718
CAS 20312-36-1
Molecular Weight (g/mol) 165.17
ChEBI CHEBI:43065
MDL Number MFCD00004244
SMILES O[C@@H](CC1=CC=CC=C1)C([O-])=O
Synonym l---3-phenyllactic acid,s-2-hydroxy-3-phenylpropionic acid,s-2-hydroxy-3-phenylpropanoic acid,l--3-phenyllactic acid,s---3-phenyllactic acid,l-3-phenyllactic acid,d-3-phenyllactic acid,2s-2-hydroxy-3-phenylpropanoic acid,s-3-phenyllactic acid,s---2-hydroxy-3-phenylpropionic acid
IUPAC Name (2S)-2-hydroxy-3-phenylpropanoic acid
InChI Key VOXXWSYKYCBWHO-QMMMGPOBSA-M
Molecular Formula C9H9O3