Mrv0541 01131411332D          

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  1  3  1  0  0  0  0
  1 10  1  1  0  0  0
 21  2  1  0  0  0  0
  2  3  1  0  0  0  0
  2  4  1  0  0  0  0
  3  5  1  0  0  0  0
  3  9  1  6  0  0  0
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  4  6  1  6  0  0  0
 24  5  1  0  0  0  0
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  6  8  2  0  0  0  0
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 11 12  2  0  0  0  0
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 14 15  2  0  0  0  0
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 21 22  2  0  0  0  0
 24 23  1  0  0  0  0
 24 25  1  0  0  0  0
M  END
> <ID>
CHEBI:53706

> <NAME>
phenoxymethylpenicillanyl group

> <DEFINITION>
The acyl group formed from phenoxymethylpenicillin.

> <STAR>
3

> <SYNONYM>
{(2S,5R,6R)-3,3-dimethyl-7-oxo-6-[(phenoxyacetyl)amino]-4-thia-1-azabicyclo[3.2.0]hept-2-yl}carbonyl; PVA; phenoxymethylpenicillanyl; phenoxomethylpenicillanyl

> <IUPAC_NAME>
2,2-dimethyl-6beta-[(phenoxyacetyl)amino]penam-3alpha-carbonyl

> <FORMULA>
C16H17N2O4S

> <MASS>
333.38200

> <MONOISOTOPIC_MASS>
333.09090

> <CHARGE>
0

> <SMILES>
[C@H]1(C(N2[C@@]1(SC([C@@H]2C(*)=O)(C)C)[H])=O)NC(=O)COC3=CC=CC=C3

> <PUBMED_CITATION>
16033609

$$$$