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Chemical structure of Phenethicillin sodium

GC70792

Phenethicillin sodium

Also known as sodium (2S,6R)-3,3-dimethyl-7-oxo-6-(2-phenoxypropanoylamino)-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate

Phenethicillin (α-Phenoxyethylpenicillin) sodium is a Penicillin, and has antimicrobial activity

ChemicalCAS30302-52-4MW386.4FormulaC17H19N2NaO5S
CAS number
30302-52-4
Molecular weight
386.4
Formula
C17H19N2NaO5S
InChIKey
HZRQUJWXQAEVBK-BWVWTODUSA-M
Catalogue number
GC70792
Brand
GLPBIO
Computed properties PubChem CID 139025655 · TPSA 124 Ų · H-bond donors 1 · H-bond acceptors 6
TPSA
124 Ų
H-bond donors
1
H-bond acceptors
6
Rotatable bonds
5
Heavy atoms
26

SMILES CC(C(=O)N[C@H]1C2N(C1=O)[C@H](C(S2)(C)C)C(=O)[O-])OC3=CC=CC=C3.[Na+]

Computed descriptors from PubChem (CID 139025655), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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