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Piperacillin (Sodium) EP Impurity M

CAT: 1299-RM-P180326-01Size: 10 mgDry Ice: NoHazardous: No
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CAT#:1299-RM-P180326-01Size:10 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
64844-70-8
Synonyms
(2S,5R,6R) -6- ((R) -2- (3- (2- (1-carboxy-N-ethylformamido) ethyl) ureido) -2-phenylacetamido) -3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid
Molecular Formula
C23H29N5O8S
Molecular Weight
535.57
Target Alternative Name
Piperacillin
Product Name Synonym
(2S,5R,6R) -6- ((R) -2- (3- (2- (1-carboxy-N-ethylformamido) ethyl) ureido) -2-phenylacetamido) -3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid

Chemical Information

Piperacillin Oxalylamide ~85%
CAS Number64844-70-8
PubChem CID139025569
IUPAC Name(2S,5R,6R)-6-[[(2R)-2-[2-[ethyl(oxalo)amino]ethylcarbamoylamino]-2-phenylacetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid
Molecular FormulaC23H29N5O8S
Molecular Weight535.6
XLogP0.6
Topological Polar Surface Area211
Hydrogen Bond Donor Count5
Hydrogen Bond Acceptor Count9
Rotatable Bond Count10
Heavy Atom Count37
Formal Charge0
Complexity953
SMILES
CCN(CCNC(=O)N[C@H](C1=CC=CC=C1)C(=O)N[C@H]2[C@@H]3N(C2=O)[C@H](C(S3)(C)C)C(=O)O)C(=O)C(=O)O
InChI
InChI=1S/C23H29N5O8S/c1-4-27(18(31)21(34)35)11-10-24-22(36)26-13(12-8-6-5-7-9-12)16(29)25-14-17(30)28-15(20(32)33)23(2,3)37-19(14)28/h5-9,13-15,19H,4,10-11H2,1-3H3,(H,25,29)(H,32,33)(H,34,35)(H2,24,26,36)/t13-,14-,15+,19-/m1/s1
InChIKey
YXRSTHOXBOCROS-BKEDOTJMSA-N
Chemical Structure
2D Structure
2D structure of Piperacillin Oxalylamide ~85%
CAS: 64844-70-8
CID: 139025569
Formula: C23H29N5O8S
MW: 535.6
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight535.6
XLogP30.6
Hydrogen Bond Donor Count5
Hydrogen Bond Acceptor Count9
Rotatable Bond Count10
Exact Mass535.17368407
Monoisotopic Mass535.17368407
Topological Polar Surface Area211 Ų
Heavy Atom Count37
Formal Charge0
Complexity953
Isotope Atom Count0
Defined Atom Stereocenter Count4
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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Alternative Products

CatalogName
AR-P31752-01Piperacillin EP Impurity S Sodium Salt (Piperacillin Penicillamide Sodium Salt)
AR-P31745-01Piperacillin Impurity 28 Sodium Salt
AR-P31747-01Piperacillin Impurity 30 Sodium Salt
AR-P31749-01Piperacillin Impurity 32 Sodium Salt
AR-P31750-01Piperacillin Impurity 33 Sodium Salt
AR-P02038-01Piperacillin Sodium EP Impurity G
AR-P31742-01Piperacillin Impurity 25 Sodium Salt
AR-P31743-01Piperacillin Impurity 26 Sodium Salt
AR-P31744-01Piperacillin Impurity 27 Sodium Salt
AR-P31748-01Piperacillin Impurity 31 Sodium Salt

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