Basic information
- CAS
1926-48-3- Standard SMILES
CC1(C)S[C@@H]2[C@H](NC(=O)C(Oc3ccccc3)c3ccccc3)C(=O)N2[C@H]1C(=O)O- InChIKey
VZPPEUOYDWPUKO-MQWDNKACSA-N- Molecular formula
- C22H22N2O5S
- Average molar mass
- 426.5 g/mol
- Monoisotopic mass
- 426.12494298
Overview
Fenbenicillin is a dipeptide.
Names & identifiers
- Preferred name
- Fenbenicillin
- IUPAC
- (2S,5R,6R)-3,3-dimethyl-7-oxo-6-[(2-phenoxy-2-phenylacetyl)amino]-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid
- English name
- Fenbenicillin
- Molecular formula
- C22H22N2O5S
- Molecular weight
- 426.491
Names & synonyms
FenbenicillinFenbenicilinaFenbenicillinePhenbenicillinFenbenicillinumFenbenicillin [INN](alpha-Phenoxybenzyl)penicillinFenbenicillin [INN:BAN]UNII-641EDA6X6LFenbenicilina [INN-Spanish]Fenbenicilline [INN-French]Fenbenicillinum [INN-Latin]
Show more names
Fenbenicillin USP/EP/BP(6R)-6-[(α-Phenoxybenzyl)carbonylamino]penicillanic acid(2S,5R,6R)-3,3-Dimethyl-7-oxo-6-(2-phenoxy-2-phenylacetamido)-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid(2S,5R,6R)-3,3-dimethyl-7-oxo-6-[[2-(phenoxy)-2-phenylacetyl]amino]-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid(2S,5R,6R)-7-keto-3,3-dimethyl-6-[[2-(phenoxy)-2-phenyl-acetyl]amino]-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid(2S,5R,6R)-3,3-dimethyl-7-oxo-6-[[2-(phenoxy)-2-phenyl-ethanoyl]amino]-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid
641EDA6X6LFENBENICILLIN [MI]Fenbenicilina (INN-Spanish)Fenbenicilline (INN-French)Fenbenicillinum (INN-Latin)phenoxybenzyl penicillinRefChem:1401071926-48-3
Properties
Computed structural properties
- XLogP
- 3.5
- Topological polar surface area
- 121 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 6
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 687
Experimental & physicochemical properties
DrugsPharmaceuticals -> Antibiotics
Physicochemical properties
- FDA UNII
- 641 EDA6X6L · 641EDA6X6L
Chemistry & industry
Suppliers2 total
杭州摩库生物医药科技有限公司+86-057181025280; +8617767106207 · [email protected]
陕西缔都医药化工有限公司+86-29-81139210 +86-17392587031 · [email protected]
Additional notes
DefinitionChEBI: Fenbenicillin is a dipeptide.
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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