General Information of the Compound
| Compound ID |
CP0055313
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| Compound Name |
Bactocill
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| Synonyms |
(2S,5R,6R)-3,3-dimethyl-6-[(5-methyl-3-phenyl-1,2-oxazole-4-carbonyl)amino]-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid
(2S,5R,6R)-3,3-dimethyl-6-{[(5-methyl-3-phenylisoxazol-4-yl)carbonyl]amino}-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid
(5-methyl-3-phenyl-4-isoxazolyl)penicillin
2,2-dimethyl-6beta-(5-methyl-3-phenyl-1,2-oxazole-4-carboxamido)penam-3alpha-carboxylic acid
5-Methyl-3-phenyl-4-isoxazolyl-penicillin
6beta-(5-methyl-3-phenylisoxazol-4-yl)penicillanic acid
Bactocill
Bactocill (TN)
MPI-penicillin
MPi-PC
OXACILLIN SODIUM
Ossacillina
Ossacillina [DCIT]
Oxacilina
Oxacilina (TN)
Oxacilina [INN-Spanish]
Oxacillin
Oxacillin (INN)
Oxacillin [INN:BAN]
Oxacillin, Monosodium Salt, Anhydrous
Oxacilline
Oxacilline [INN-French]
Oxacillinum
Oxacillinum [INN-Latin]
Oxazocillin
Oxazocilline
Penicillin, Methylphenylisoxazolyl
Prostaphlin
Prostaphlyn
Sodium oxacillin
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| Structure |
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| Formula |
C19H19N3O5S
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| Molecular Weight |
401.444
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| Canonical SMILES |
Cc1onc(c1C(=O)N[C@H]1[C@H]2SC(C)(C)[C@@H](N2C1=O)C(O)=O)-c1ccccc1
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| InChI |
InChI=1S/C19H19N3O5S/c1-9-11(12(21-27-9)10-7-5-4-6-8-10)15(23)20-13-16(24)22-14(18(25)26)19(2,3)28-17(13)22/h4-8,13-14,17H,1-3H3,(H,20,23)(H,25,26)/t13-,14+,17-/m1/s1
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| InChIKey |
UWYHMGVUTGAWSP-JKIFEVAISA-N
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| CAS |
66-79-5
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| Physicochemical Property |
"RO5" indicates the cutoff set by lipinski's rule of five: (1) Molecular weight less than 500 Dalton; (2) xlogp less than 5; (3) No more than 5 hbonddonor (Hydrogen Bond Donor Count); (4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count); (5) No more than 10 rotbonds (Rotatable Bond Count). Show/Hide
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Map of Molecular Bioactivity Related to the Compound
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Map of Molecular Bioactivity Related to the Compound Compound Cell Line Protein Bioactivity Value: <= 0.1 μM > 0.1 μM and <= 10 μM > 10 μM Imprecise Activity |
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Table of Molecular Bioactivities Related to the Compound
Clinical Information about the Compound