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Home/Compounds/CAS 61477-96-1
Formula C23H27N5O7SMW 517.6Research-use catalog entryCOA/SDS by request

Piperacillin

CAS Number: 61477-96-1

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Loading RDKit molecule structure...
InChIKey: IVBHGBMCVLDMKU-GXNBUGAJSA-NC23H27N5O7S | MW 517.6

Chemical Absolute Identifiers

CAS Number

61477-96-1

PubChem CID

43672

Molecular Formula

C23H27N5O7S

Molecular Weight

517.6 g/mol

Exact Mass

517.163119

InChIKey

IVBHGBMCVLDMKU-GXNBUGAJSA-N

IUPAC Name

(2S,5R,6R)-6-[[(2R)-2-[(4-ethyl-2,3-dioxopiperazine-1-carbonyl)amino]-2-phenylacetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid

SMILES String

CCN1CCN(C(=O)C1=O)C(=O)N[C@H](C2=CC=CC=C2)C(=O)N[C@H]3[C@@H]4N(C3=O)[C@H](C(S4)(C)C)C(=O)O

Physical Properties

Water Solubility

0.119 g/L

Properties are provided as catalog reference data and may be confirmed through supplier documentation when required.

Catalog Facts

Structural features

Piperacillin (CAS 61477-96-1) is listed in the Advanced Chemicals portfolio, with molecular formula C23H27N5O7S and molecular weight 517. 60 g/mol.

Sourcing context

Catalog reference for RFQ preparation, supplier confirmation, and research chemical sourcing review.

Research use context

Intended for research building-block and synthetic chemistry workflows; structure-derived tags include nitrogen-containing heterocycle.

Documentation needs

COA/SDS status, availability, lead time, pack size, and shipment documentation can be confirmed during quotation.

Applications & Classification

Organic Building BlocksSynthetic ChemistryResearch intermediateCustom synthesis building blockResearch chemical sourcingCustom synthesis and catalog availability reviewCOA, SDS, pricing, and fulfillment workflow
Biological target reference

ChEMBL reports experimental activity evidence for: PER-2 beta-lactamase (Citrobacter freundii) — 4 assays; Beta-lactamase SHV-1 (Klebsiella pneumoniae) — 4 assays; BlaVIM-1 (Escherichia coli) — 4 assays; Carbapenem-hydrolyzing beta-lactamase KPC (Klebsiella pneumoniae) — 4 assays; Beta-lactamase (Enterobacter cloacae) — 3 assays. These records describe research assays and do not establish therapeutic efficacy or clinical use.

PER-2 beta-lactamase

Citrobacter freundii · SINGLE PROTEIN · 4 qualifying assays · 1 documents · best pChEMBL 6.7

Experimental evidence source: ChEMBL

Beta-lactamase SHV-1

Klebsiella pneumoniae · SINGLE PROTEIN · 4 qualifying assays · 2 documents

Experimental evidence source: ChEMBL

BlaVIM-1

Escherichia coli · SINGLE PROTEIN · 4 qualifying assays · 2 documents

Experimental evidence source: ChEMBL

Carbapenem-hydrolyzing beta-lactamase KPC

Klebsiella pneumoniae · SINGLE PROTEIN · 4 qualifying assays · 2 documents

Experimental evidence source: ChEMBL

Beta-lactamase

Enterobacter cloacae · SINGLE PROTEIN · 3 qualifying assays · 1 documents

Experimental evidence source: ChEMBL

Safety & Handling

Handling & Storage

  • Keep container tightly closed and dry.
  • Store in a well-ventilated place.
  • Avoid contact with skin and eyes.

PPE

Respiratory protection if needed

First Aid

  • Do not give anything to an unconscious person.
  • Rinse mouth with water.

Stability / Reactivity

  • Reactivity and stability.
  • Carbon monoxide, carbon dioxide, nitrogen oxides, sulfur oxides.

Disposal

  • Waste product: Dispose of remaining and non-recyclable solutions to a licensed company.
  • Contact a professional institution with a waste disposal license to handle this substance.
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Accidental Release

  • Do not generate dust when collecting and disposing.
  • Sweep and shovel up.

For supplier-issued SDS, request documentation before handling, storage, shipment, or procurement decisions.

Preliminary Safety Reference

For supplier-issued SDS or COA, submit a documentation request.

Safety Reference / SDS Request

Names & Synonyms / External Identifiers

Chemical Name

Piperacillin

Names & Synonyms

Piperacillin anhydrousPiperacillinePiperacilinaPeracinPiperacillina
Show all synonyms
PiperacillinumPIPCPipercillin(2S,5R,6R)-6-{[(2R)-2-{[(4-ethyl-2,3-dioxopiperazin-1-yl)carbonyl]amino}-2-phenylacetyl]amino}-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acidAB Piperacillin4-Thia-1-azabicyclo(3.2.0)heptane-2-carboxylic acid, 6-(((((4-ethyl-2,3-dioxo-1-piperazinyl)carbonyl)amino)phenylacetyl)amino)-3,3-dimethyl-7-oxo-, (2S-(2alpha,5alpha,6beta(S*)))-(2S,5R,6R)-6-[(2R)-2-{[(4-ethyl-2,3-dioxopiperazin-1-yl)carbonyl]amino}-2-phenylacetamido]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid(2S,5R,6R)-6-((R)-2-(4-Ethyl-2,3-dioxo-1-piperazinecarboxamido)-2-phenylacetamido)-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo(3.2.0)heptane-2-carboxylic acid monohydratePipera hameln(2S,5R,6R)-6-(((2R)-2-(((4-ethyl-2,3-dioxopiperazin-1-yl)carbonyl)amino)-2-phenylacetyl)amino)-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo(3.2.0)heptane-2-carboxylic acid(2S,5R,6R)-6-(((2R)-2-((4-ethyl-2,3-dioxopiperazine-1-carbonyl)amino)-2-phenylacetyl)amino)-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo(3.2.0)heptane-2-carboxylic acid(2S,5R,6R)-6-((2R)-2-(((4-ethyl-2,3-dioxopiperazin-1-yl)carbonyl)amino)-2-phenylacetamido)-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo(3.2.0)heptane-2-carboxylic acidPiperacillin curasanCurasan, Piperacillin
External Identifiers
EC NUMBER: 262-811-8DSSTOX SUBSTANCE ID: DTXSID2023482CHEMBL ID: CHEMBL702CHEBI ID: CHEBI:8232UNII: 9I628532GXDRUGBANK ID: DB00319HMDB ID: HMDB0014464KEGG ID: C14034KEGG ID: D08380METABOLOMICS WORKBENCH ID: 42704NCI THESAURUS CODE: C61891NCI THESAURUS CODE: C62069PHARMGKB ID: PA450975RXCUI: 1546000WIKIDATA ID: Q423787
Literature & Patent References
DOI 10.1016/j.isci.2024.108907Identification and evaluation of small-molecule inhibitors against the dNTPase SAMHD1 via a comprehensive screening funnelPMID 38318365Identification and evaluation of small-molecule inhibitors against the dNTPase SAMHD1 via a comprehensive screening funnelDOI 10.1016/j.ejmech.2023.115630Optimization of pyridylpiperazine-based inhibitors of the Escherichia coli AcrAB-TolC efflux pump.PMID 37459793Optimization of pyridylpiperazine-based inhibitors of the Escherichia coli AcrAB-TolC efflux pump.DOI 10.1016/j.ejmech.2021.113975Nitroxoline and its derivatives are potent inhibitors of metallo-β-lactamases.PMID 34865870Nitroxoline and its derivatives are potent inhibitors of metallo-β-lactamases.DOI 10.1016/j.ejmech.2021.113691Synthetic cajaninstilbene acid derivatives eradicate methicillin-resistant Staphylococcus aureus persisters and biofilms.PMID 34274830Synthetic cajaninstilbene acid derivatives eradicate methicillin-resistant Staphylococcus aureus persisters and biofilms.

Documentation & Compliance Facts

Compliance Facts

Shipment review: Required

Documentation available by request

Certificate of Analysis (COA): By request

Supplier Safety Data Sheet (SDS): By request

Purity and pack size confirmation: By request

Availability and lead time review: Confirmed by RFQ

Shipment documentation review: By request

For supplier-issued documentation by request, use the RFQ actions on this page.Review preliminary safety reference

What happens after RFQ

  1. 1We review the CAS identity, quantity, and documentation request.
  2. 2We check sourcing options, supplier availability, COA/SDS, purity, pack size, and lead time.
  3. 3We review destination and shipment documentation needs when applicable.
  4. 4We follow up with a quotation or clarification request.

Text Reference Cues

Additional text reference cues are not available for this catalog entry.

Non-public references are shown as text only and do not imply equivalence, availability, or shared use.

Catalog navigation

Related Catalog Entries

Other public CAS pages in this catalog. These links support navigation across additional intermediates and do not imply equivalence, availability, or shared use.

CAS 55268-75-2CefuroximeCAS 69-53-4AmpicillinCAS 89786-04-9TazobactamCAS 1002310-00-0Tert-butyl 1-(2-chloro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)ethylcarbamateCAS 1005174-17-3(E)-3-(2-Propyl-6-(trifluoromethyl)pyridin-3-yl)acrylic acidCAS 1018125-49-92-(3-Cyclopropyl-6-ethyl-4-(trifluoromethyl)-1H-pyrazolo[3,4-b]pyridin-1-yl)acetic acidCAS 1018128-07-8Isopropyl 4-chloro-2-methylquinoline-6-carboxylateCAS 1018142-22-76-cyclopropyl-1-(2,2-difluoroethyl)-3-methyl-1H-pyrazolo[3,4-b]pyridine-4-carboxylic acidCAS 1018144-00-72-(3-Cyclopropyl-6-isopropyl-4-(trifluoromethyl)-1H-pyrazolo[3,4-b]pyridin-1-yl)acetic acid

RFQ questions for CAS 61477-96-1

What are the key identifiers for Piperacillin (CAS 61477-96-1)?

Piperacillin is identified by CAS 61477-96-1, with molecular formula C23H27N5O7S, molecular weight 517.6, InChIKey IVBHGBMCVLDMKU-GXNBUGAJSA-N.

Does CAS 61477-96-1 have reported biological target evidence?

ChEMBL contains qualifying experimental assay evidence associated with PER-2 beta-lactamase, Beta-lactamase SHV-1, BlaVIM-1, Carbapenem-hydrolyzing beta-lactamase KPC, Beta-lactamase. These records do not establish therapeutic efficacy or clinical use.

Can I request a COA for CAS 61477-96-1?

Yes. Submit an RFQ and specify COA requirements. Lot-specific COA depends on supplier confirmation.

Can I request supplier SDS for Piperacillin?

Yes. Supplier SDS can be requested through the RFQ workflow before handling, storage, shipment, or procurement decisions.

Is CAS 61477-96-1 available for quotation?

Availability, pack size, lead time, and pricing are confirmed through RFQ.

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