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Cefathiamidine - 97%, high purity , CAS No.33075-00-2

    Grade & Purity:
  • ≥97%
In stock
Item Number
C347480
Grouped product items
SKU Size
Availability
Price Qty
C347480-25mg
25mg
3
$83.90
C347480-100mg
100mg
3
$302.90
C347480-500mg
500mg
3
$1,360.90
C347480-2.5g
2.5g
3
$6,123.90
C347480-10g
10g
3
$22,044.90
C347480-50g
50g
2
$99,202.90

Basic Description

Synonyms D81831 | 5-Thia-1-azabicyclo(4.2.0)oct-2-ene-2-carboxylic acid, 3-((acetyloxy)methyl)-7-((((((1-methylethyl)amino)((1-methylethyl)imino)methyl)thio)acetyl)amino)-8-oxo-, (6R-trans)- | 3-Chloromethylacetophenone | (6R,7R)-3-(acetyloxymethyl)-7-[[2-[N,N'-di
Specifications & Purity ≥97%
Storage Temp Store at 2-8°C
Shipped In
Wet ice
This product requires cold chain shipping. Ground and other economy services are not available.

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
Superclass Organoheterocyclic compounds
Class Lactams
Subclass Beta lactams
Intermediate Tree Nodes Cephems - Cephalosporins
Direct Parent Cephalosporin 3'-esters
Alternative Parents N-acyl-alpha amino acids and derivatives  1,3-thiazines  Dicarboxylic acids and derivatives  Tertiary carboxylic acid amides  Secondary carboxylic acid amides  Isothioureas  Azetidines  Carboxylic acid esters  Thiohemiaminal derivatives  Sulfenyl compounds  Propargyl-type 1,3-dipolar organic compounds  Azacyclic compounds  Dialkylthioethers  Carboxylic acids  Carboximidamides  Carbonyl compounds  Hydrocarbon derivatives  Organic oxides  Organopnictogen compounds  
Molecular Framework Aliphatic heteropolycyclic compounds
Substituents Cephalosporin 3'-ester - N-acyl-alpha amino acid or derivatives - Alpha-amino acid or derivatives - Meta-thiazine - Dicarboxylic acid or derivatives - Tertiary carboxylic acid amide - Azetidine - Carboxamide group - Carboxylic acid ester - Isothiourea - Secondary carboxylic acid amide - Carboximidamide - Hemithioaminal - Thioether - Azacycle - Dialkylthioether - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Sulfenyl compound - Carboxylic acid derivative - Carboxylic acid - Hydrocarbon derivative - Organopnictogen compound - Organic nitrogen compound - Organic oxygen compound - Organic oxide - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Carbonyl group - Aliphatic heteropolycyclic compound
Description This compound belongs to the class of organic compounds known as cephalosporin 3'-esters. These are cephalosporins that are esterified at the 3'-position.
External Descriptors Not available

Associated Targets(non-human)

Hdac6 Histone deacetylase 6 (222 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
Klebsiella pneumoniae (43867 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
Staphylococcus aureus (210822 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
Escherichia coli (133304 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
rep Replicase polyprotein 1ab (378 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID

Mechanisms of Action

Mechanism of Action Action Type target ID Target Name Target Type Target Organism Binding Site Name References

Names and Identifiers

Pubchem Sid 504767982
Pubchem Sid Url https://pubchem.ncbi.nlm.nih.gov/substance/504767982
IUPAC Name (6R,7R)-3-(acetyloxymethyl)-7-[[2-[N,N'-di(propan-2-yl)carbamimidoyl]sulfanylacetyl]amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
INCHI InChI=1S/C19H28N4O6S2/c1-9(2)20-19(21-10(3)4)31-8-13(25)22-14-16(26)23-15(18(27)28)12(6-29-11(5)24)7-30-17(14)23/h9-10,14,17H,6-8H2,1-5H3,(H,20,21)(H,22,25)(H,27,28)/t14-,17-/m1/s1
InChIKey JYXACOFERDBGGQ-RHSMWYFYSA-N
Smiles CC(C)NC(=NC(C)C)SCC(=O)NC1C2N(C1=O)C(=C(CS2)COC(=O)C)C(=O)O
Isomeric SMILES CC(C)NC(=NC(C)C)SCC(=O)N[C@H]1[C@@H]2N(C1=O)C(=C(CS2)COC(=O)C)C(=O)O
Molecular Weight 472.58
Reaxy-Rn 21460017
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=21460017&ln=

Certificates(CoA,COO,BSE/TSE and Analysis Chart)

C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:

Find and download the COA for your product by matching the lot number on the packaging.

6 results found

Lot Number Certificate Type Date Item
I2227343 Certificate of Analysis Jul 21, 2022 C347480
I2227344 Certificate of Analysis Jul 21, 2022 C347480
I2227345 Certificate of Analysis Jul 21, 2022 C347480
I2227349 Certificate of Analysis Jul 21, 2022 C347480
I2227351 Certificate of Analysis Jul 21, 2022 C347480
I2227350 Certificate of Analysis Jul 21, 2022 C347480

Chemical and Physical Properties

Melt Point(°C) 164-170° C
Molecular Weight 472.600 g/mol
XLogP3 0.500
Hydrogen Bond Donor Count 3
Hydrogen Bond Acceptor Count 9
Rotatable Bond Count 11
Exact Mass 472.145 Da
Monoisotopic Mass 472.145 Da
Topological Polar Surface Area 188.000 Ų
Heavy Atom Count 31
Formal Charge 0
Complexity 811.000
Isotope Atom Count 0
Defined Atom Stereocenter Count 2
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
The total count of all stereochemical bonds 0
Covalently-Bonded Unit Count 1

Solution Calculators

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