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Ligand Name: phenylpyruvate |
Ligand Type: peptide-like |
Ligand ID: COVPDB902 |
PubChem:
997
|
Synonym(s):
- phenylpyruvic acid
- 2-oxo-3-phenylpropanoic acid
- 156-06-9
- 3-phenylpyruvic acid
- pyruvic acid, phenyl-
- beta-phenylpyruvic acid
- phenyl pyruvic acid
- 3-phenyl-2-oxopropanoate
- alpha-ketohydrocinnamic acid
- benzenepropanoic acid, .alpha.-oxo-
- 3-phenyl-2-oxopropanoic acid
- unii-x7co62m413
- phenylpyroracemic acid
- chebi:30851
- benzenepropanoic acid, alpha-oxo-
- 2-oxo-3-phenyl-propionic acid
- x7co62m413
- mfcd00002589
- b-phenylpyruvic acid
- ppy
- 2-oxo-3-phenylpropionic acid
- alpha-keto-dl-phenylalanine
- 2-oxo-3-phenylpropanic acid
- 2-oxo-3-phenyl-propanoic acid
- b-phenylpyruvate
- phenylpyroracemate
- 4kif
- beta-phenylpyruvate
- phenyl-pyruvic acid
- einecs 205-847-1
- a-hydroxycinnamic acid
- phenylbrenztraubensaeure
- alpha-ketohydrocinnamate
- .beta.-phenylpyruvic acid
- phenylpyruvic acid, 98%
- acmc-209dd9
- dsstox_cid_22281
- dsstox_rid_79988
- dsstox_gsid_42281
- schembl43235
- alpha-oxo-benzenepropanoic acid
- a-oxobenzenepropanoic acid, 9ci
- chembl1162488
- dtxsid1042281
- fema 3892
- zinc901485
- tox21_301362
- 7828aa
- anw-21595
- arj102154
- bdbm50167651
- geo-02572
- s6131
- sbb012361
- akos000161798
- cs-w013246
- db03884
- hy-w012530
- mcule-9935480822
- phenylpyruvic acid, analytical standard
- ncgc00255726-01
- ak-90109
- cas-156-06-9
- st068813
- 2-hydroxy-3-phenyl-2-propenoic acid, 9ci
- ac-116009
- db-043302
- phenylpyruvic acid, purum, >=98.0% (t)
- ft-0631855
- p0154
- en300-49247
- c00166
- 1r-0191
- q425030
- sr-01000580517
- q-201562
- sr-01000580517-1
- 2-oxo-3-phenylpropanoic acid (mixture oxo and keto)
- 7d5f143e-52e8-4fbb-87f1-0d4f96b4ca60
- z1270443861
show 79 synonym(s)
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DrugBank: DB03884 |
ChEMBL: CHEMBL1162488 |
Canonical SMILES: OC(=O)C(=O)Cc1ccccc1 |
Standard InChI: InChI=1S/C9H8O3/c10-8(9(11)12)6-7-4-2-1-3-5-7/h1-5H,6H2,(H,11,12) |
Molecular Formula: C9H8O3 |
Mol. Weight: 164.04735 |
logP: 0.8828 |
HBD: 1 | HBA: 2 |
#Rotatable Bonds: 3 | TPSA: 54.37 |