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Structure
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| Relationships |
Total Number of functionally related protein(s) :
50
Total Number of Articles : 52
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| PubChem |
997
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| Molecular Formula |
C9H8O3 |
| SMILES |
C1=CC=C(C=C1)CC(=O)C(=O)O |
| InChI |
InChI=1S/C9H8O3/c10-8(9(11)12)6-7-4-2-1-3-5-7/h1-5H,6H2,(H,11,12) |
| synonyms |
- phenylpyruvic acid
- 156-06-9
- 2-Oxo-3-phenylpropanoic acid
- 3-Phenylpyruvic acid
- Pyruvic acid, phenyl-
- beta-Phenylpyruvic acid
- Benzenepropanoic acid, alpha-oxo-
- Phenylpyroracemic acid
- keto-phenylpyruvic acid
- 3-Phenyl-2-oxopropanoic acid
- 2-OXO-3-PHENYLPROPIONIC ACID
- Benzenepropanoic acid, .alpha.-oxo-
- CHEBI:30851
- .beta.-Phenylpyruvic acid
- 2-Oxo-3-phenylpropanic acid
- DTXSID1042281
- Phenylbrenztraubensaeure
- X7CO62M413
- EINECS 205-847-1
- alpha-oxo-benzenepropanoic acid
- ALPHA-KETO-PHENYLALANINE
- DTXCID9022281
- FEMA NO. 3892
- PHENYLPYRUVIC ACID [WHO-DD]
- 3-PHENYL-2-OXO PROPIONIC ACID
- .ALPHA.-OXOBENZENEPROPANOIC ACID
- 2-OXO-3-PHENYLPROPIONIC ACID [FHFI]
- 3Phenylpyruvic acid
- 2Oxo3phenylpropanoic acid
- 2Oxo3phenylpropionic acid
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| Properties |
| Property |
Value |
| MW |
164.16 g/mol |
| HBD |
1 |
| HBA |
3 |
| Rotatable Bond Count |
3 |
| Exact Mass |
164.047344113 g/mol |
| Monoisotopic Mass |
164.047344113 g/mol |
| Heavy Atom Count |
12 |
| Isotope Atom Count |
0 |
| Atom Stereo Count |
0 |
| Covalent Unit Count |
1 |
| Complexity |
180 |
| xlogp |
1.3 |
| Topological Polar Surface Area |
54.4 |
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