4’-Bromo Ampicillin - CAS 1356019-52-7?

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Catalog Number: R046548

CAS Number: 1356019-52-7?

PubChem Substance ID:355127763

Molecular Formula: C16H18BrN3O4S

Molecular Weight:428.301

Purity: ≥95%

* For research use only. Not for human or veterinary use.

Synonym

Synonyms(2S,5R,6R)-6-[[(2R)-2-Amino-2-(4-bromophenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic Acid;

Property

Molecular Formula: C16H18BrN3O4S
Molecular Weight428.301
Purity≥95%
Storage-20°C

Computed Descriptor

IUPAC Name(2S,5R,6R)-6-[[(2R)-2-amino-2-(4-bromophenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid
InChIInChI=1S/C16H18BrN3O4S/c1-16(2)11(15(23)24)20-13(22)10(14(20)25-16)19-12(21)9(18)7-3-5-8(17)6-4-7/h3-6,9-11,14H,18H2,1-2H3,(H,19,21)(H,23,24)/t9-,10-,11+,14-/m1/s1
InChIKeyYHGWQHFZQZNZCJ-NJBDSQKTSA-N
SMILESCC1(C(N2C(S1)C(C2=O)NC(=O)C(C3=CC=C(C=C3)Br)N)C(=O)O)C