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keto-phenylpyruvate

PropertiesImage
MNX_IDMNXM730221 Image of MNXM730221
referencechebi:18005
formulaC9H7O3
global charge-1
mol weight163.152
InChIKeyBTNMPGBKDVTSJY-UHFFFAOYSA-M
InChIInChI=1S/C9H8O3/c10-8(9(11)12)6-7-4-2-1-3-5-7/h1-5H,6H2,(H,11,12)/p-1
SMILESO=C([O-])C(=O)Cc1ccccc1
MNX internals
InChI (mnx)InChI=1/C9H8O3/c10-8(9(11)12)6-7-4-2-1-3-5-7/h1-5H,6H2,(H,11,12) Image of MNXM730221
SMILES (mnx)[cH:1]1[cH:2][cH:4][c:7]([CH2:6][C:8]([C:9](=[O:11])[OH:12])=[O:10])[cH:5][cH:3]1
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)71
in models (compartimentalized) 44
Similar chemical compounds in external resources
IdentifierDescription

reactome:R-ALL-2160466
reactomeM:R-ALL-2160466
reactome:R-ALL-2160487
reactomeM:R-ALL-2160487
CHEBI:18005
chebi:18005
BTNMPGBKDVTSJY-UHFFFAOYSA-M 		keto-phenylpyruvate
2-oxo-3-phenylpropanoate
3-(4-hydroxyphenyl)pyruvate
3-phenyl-2-oxopropanoate
3-phenylpyruvate
hmdb:HMDB0304081
BTNMPGBKDVTSJY-UHFFFAOYSA-M 		2-oxo-3-phenylpropanoate
2-oxo-3-Phenylpropanoic acid
3-(4-Hydroxyphenyl)pyruvate
3-(4-Hydroxyphenyl)pyruvic acid
3-Phenyl-2-oxopropanoate
3-Phenyl-2-oxopropanoic acid
3-Phenylpyruvate
3-Phenylpyruvic acid
Keto-phenylpyruvic acid
Phenylpyruvate
Phenylpyruvic acid
Phenylpyruvic acid, calcium salt
Phenylpyruvic acid, sodium salt
beta-Phenylpyruvic acid
beta-phenylpyruvate
beta-phenylpyruvic acid

metacyc.compound:PHENYL-PYRUVATE
metacycM:PHENYL-PYRUVATE
BTNMPGBKDVTSJY-UHFFFAOYSA-M 		3-phenyl-2-oxopropanoate
2-oxo-3-phenylpropanoate
3-phenylpyruvate
3-phenylpyruvic acid
alpha-ketohydrocinnamic acid
keto-phenylpyruvate
phenylpyruvate

bigg.metabolite:phpyr
biggM:phpyr
BTNMPGBKDVTSJY-UHFFFAOYSA-M 		Phenylpyruvate

seed.compound:cpd00143
seedM:cpd00143
BTNMPGBKDVTSJY-UHFFFAOYSA-M 		Phenylpyruvate
2-Oxo-3-phenylpropanoate
2-keto-phenyl-pyruvate
2-oxo-3-phenylpropanoate
3-Phenyl-2-oxopropanoate
3-phenyl-2-oxopropanoate
3-phenylpyruvate
3-phenylpyruvic acid
Phenylpyruvic acid
alpha-Ketohydrocinnamic acid
alpha-ketohydrocinnamic acid
keto-Phenylpyruvate
keto-phenylpyruvate
phenylpyruvate
phpyr

kegg.compound:C00166
keggC:C00166
BTNMPGBKDVTSJY-UHFFFAOYSA-N 		Phenylpyruvate
2-Oxo-3-phenylpropanoate
3-Phenyl-2-oxopropanoate
Phenylpyruvic acid
alpha-Ketohydrocinnamic acid
keto-Phenylpyruvate

sabiork.compound:1957
sabiorkM:1957
BTNMPGBKDVTSJY-UHFFFAOYSA-N 		Phenylpyruvate
3-Phenyl-2-oxopropanoate
Keto-Phenylpyruvate
Phenylpyruvic acid
alpha-Ketohydrocinnamic acid
keto-Phenylpyruvate
hmdb:HMDB0000205
BTNMPGBKDVTSJY-UHFFFAOYSA-N 		Phenylpyruvic acid
2-Oxo-3-phenylpropanoate
2-Oxo-3-phenylpropanoic acid
2-Oxo-3-phenylpropionic acid
2-oxo-3-phenylpropanoic acid
3-PHENYLPYRUVate
3-Phenyl-2-oxopropanoate
3-Phenyl-2-oxopropanoic acid
3-Phenyl-2-oxopropionic acid
3-Phenylpyruvic acid
FEMA 3892
Keto-phenylpyruvate
Phenylbrenztraubensaeure
Phenylpyruvate
a-Hydroxycinnamic acid
a-Ketohydrocinnamate
a-Ketohydrocinnamic acid
a-Oxo-benzenepropanoate
a-Oxo-benzenepropanoic acid
alpha-Ketohydrocinnamate
alpha-Ketohydrocinnamic acid
alpha-Oxo-benzenepropanoate
alpha-Oxo-benzenepropanoic acid
alpha-Oxobenzenepropanoic acid
alpha-Oxobenzenepropionic acid
b-Phenylpyruvate
b-Phenylpyruvic acid
beta-Phenylpyruvate
beta-Phenylpyruvic acid
keto-Phenylpyruvic acid
phenylpyruvic acid

envipath:...759953ea5e07
envipathM:...759953ea5e07
BTNMPGBKDVTSJY-UHFFFAOYSA-M 		compound 0042522

vmhM:phpyr
vmhM:phpyr
vmhmetabolite:phpyr
vmhmetabolite:phpyr
BTNMPGBKDVTSJY-UHFFFAOYSA-M 		keto-phenylpyruvate
2-Hydroxy-3-phenyl-2-propenoic acid, 9ci
2-oxo-3-Phenylpropanoate
2-oxo-3-Phenylpropanoic acid
2-oxo-3-Phenylpropanoic acid (mixture oxo and keto)
3-PHENYLPYRUVIC ACID
3-PHENYLPYRUVate
3-Phenyl-2-oxopropanoate
3-Phenyl-2-oxopropanoic acid
FEMA 3892
Phenylbrenztraubensaeure
Phenylpyroracemate
Phenylpyroracemic acid
Phenylpyruvate
Phenylpyruvic acid, calcium salt
Phenylpyruvic acid, sodium salt
a-Hydroxycinnamic acid
a-Ketohydrocinnamate
a-Ketohydrocinnamic acid
a-Oxobenzenepropanoic acid, 9ci
a-oxo-Benzenepropanoate
a-oxo-Benzenepropanoic acid
alpha-Ketohydrocinnamate
alpha-Ketohydrocinnamic acid
alpha-ketohydrocinnamate
alpha-ketohydrocinnamic acid
alpha-oxo-Benzenepropanoate
alpha-oxo-Benzenepropanoic acid
alpha-oxo-benzenepropanoate
alpha-oxo-benzenepropanoic acid
b-Phenylpyruvate
b-Phenylpyruvic acid
beta-Phenylpyruvate
beta-Phenylpyruvic acid
beta-phenylpyruvate
beta-phenylpyruvic acid
keto-Phenylpyruvate
keto-Phenylpyruvic acid

CHEBI:30851
chebi:30851
BTNMPGBKDVTSJY-UHFFFAOYSA-N 		keto-phenylpyruvic acid
2-oxo-3-phenylpropanoic acid
3-PHENYLPYRUVIC ACID
3-Phenyl-2-oxopropanoate
3-phenyl-2-oxopropanoic acid
3-phenylpyruvic acid
Phenylbrenztraubensaeure
Phenylpyruvate
Phenylpyruvic acid
alpha-Ketohydrocinnamic acid
alpha-oxo-benzenepropanoic acid
beta-phenylpyruvic acid
keto-Phenylpyruvate

hmdb:HMDB0001237
hmdb:HMDB00205
hmdb:HMDB0031629
hmdb:HMDB01237
hmdb:HMDB31629
chebi:12821
chebi:14784
chebi:26007
chebi:26009
chebi:45005
chebi:8105
biggM:M_phpyr
keggC:M_C00166
seedM:M_cpd00143
vmhM:M_phpyr 		secondary/obsolete/fantasy identifier