Determine the necessary mass, volume, or concentration for preparing a solution.
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Moligand™, ≥96% Moligand™ for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
Store at -20°C Ships Ice chest + Ice pads Check lot-specific COA for exact specifications.
SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.
Cited in 1 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.
Cefotetan is an antibiotic related to Cephalosporin, used in the treatment of bacterial infections.
| Pubchem Sid | 504753672 |
|---|---|
| Pubchem Sid Url | https://pubchem.ncbi.nlm.nih.gov/substance/504753672 |
| Sonrisas canónicas | CN1C(=NN=N1)SCC2=C(N3C(C(C3=O)(NC(=O)C4SC(=C(C(=O)N)C(=O)O)S4)OC)SC2)C(=O)O |
| IUPAC Name | (6R,7S)-7-[[4-(2-amino-1-carboxy-2-oxoethylidene)-1,3-dithietane-2-carbonyl]amino]-7-methoxy-3-[(1-methyltetrazol-5-yl)sulfanylmethyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid |
| InChIKey | SRZNHPXWXCNNDU-RHBCBLIFSA-N |
| INCHI | 1S/C17H17N7O8S4/c1-23-16(20-21-22-23)34-4-5-3-33-15-17(32-2,14(31)24(15)7(5)11(29)30)19-9(26)13-35-12(36-13)6(8(18)25)10(27)28/h13,15H,3-4H2,1-2H3,(H2,18,25)(H,19,26)(H,27,28)(H,29,30)/t13?,15-,17+/m1/s1 |
| Isómeros SMILES | CN1C(=NN=N1)SCC2=C(N3[C@@H]([C@@](C3=O)(NC(=O)C4SC(=C(C(=O)N)C(=O)O)S4)OC)SC2)C(=O)O |
| RTECS | XI0330800 |
| Peso molecular | 575.62 |
| Reaxy-Rn | 1208088 |
| Reaxys-RN_link_address | https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1208088&ln= |
Comprehensive hazard, handling, storage, and regulatory compliance document.
Download SDS →Lot-specific quality data. Enter your lot number to retrieve the exact COA.
Look up COA →Full quality attributes and acceptance criteria for this grade.
View spec sheet →Taxonomy Tree
| Kingdom | Organic compounds |
|---|---|
| Superclass | Organoheterocyclic compounds |
| Clase | Lactams |
| Subclass | Beta lactams |
| Intermediate Tree Nodes | Cephems - Cephalosporins |
| Direct Parent | Cephamycins |
| Alternative Parents | N-acyl-alpha amino acids and derivatives Alkylarylthioethers Vinylogous thioesters 1,3-thiazines Dicarboxylic acids and derivatives Tetrazoles Tertiary carboxylic acid amides Heteroaromatic compounds Azetidines Secondary carboxylic acid amides Dithietanes Primary carboxylic acid amides Ketene acetals Thiohemiaminal derivatives Azacyclic compounds Sulfenyl compounds Dialkylthioethers Carboxylic acids Hydrocarbon derivatives Carbonyl compounds Organopnictogen compounds Organic oxides Organonitrogen compounds |
| Molecular Framework | Aromatic heteropolycyclic compounds |
| Substituents | Cephamycin - N-acyl-alpha amino acid or derivatives - Alpha-amino acid or derivatives - Aryl thioether - Alkylarylthioether - Meta-thiazine - Dicarboxylic acid or derivatives - Vinylogous thioester - Azole - Heteroaromatic compound - Tertiary carboxylic acid amide - Tetrazole - Azetidine - Carboxamide group - Dithietane - Ketene acetal or derivatives - Primary carboxylic acid amide - Secondary carboxylic acid amide - Hemithioaminal - Thioether - Sulfenyl compound - Azacycle - Dialkylthioether - Carboxylic acid derivative - Carboxylic acid - Organosulfur compound - Organic oxide - Hydrocarbon derivative - Organic oxygen compound - Organopnictogen compound - Carbonyl group - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Aromatic heteropolycyclic compound |
| Descripción | This compound belongs to the class of organic compounds known as cephamycins. These are compounds containing a the cephalosporin (oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid) nucleus, with an alkyloxy group attached to the C6 carbon atom. |
| External Descriptors | Not available |
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Find and download the COA for your product by matching the lot number on the packaging.
| Lot Number | Certificate Type | Fecha | Articulo |
|---|---|---|---|
| Certificate of Analysis | Feb 03, 2026 | C351756 | |
| Certificate of Analysis | Dec 08, 2025 | C351756 | |
| Certificate of Analysis | Dec 19, 2024 | C351756 | |
| Certificate of Analysis | Dec 19, 2024 | C351756 | |
| Certificate of Analysis | Dec 19, 2024 | C351756 | |
| Certificate of Analysis | Dec 19, 2024 | C351756 |
| Solubilidad | Soluble in DMSO, and methanol (Sparingly).(Slightly soluble) methanol; insoluble in water |
|---|---|
| Sensibilidad | heat sensitive |
| Índice de refracción | n20D1.92 (Predicted) |
| Punto de fusión (°C) | 173-178° C (dec.) |
| Peso molecular | 575.600 g/mol |
| XLogP3 | 0.100 |
| Hydrogen Bond Donor Count | 4 |
| Hydrogen Bond Acceptor Count | 15 |
| Rotatable Bond Count | 9 |
| Exact Mass | 575.002 Da |
| Monoisotopic Mass | 575.002 Da |
| Topological Polar Surface Area | 321.000 Ų |
| Heavy Atom Count | 36 |
| Formal Charge | 0 |
| Complexity | 1090.000 |
| 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 |
| 1. Yujia Chen, Wei Li, Li Wang, Bingmei Wang, Jian Suo. (2024) Novel inhibition of Staphylococcus aureus sortase A by plantamajoside: implications for controlling multidrug-resistant infections. APPLIED AND ENVIRONMENTAL MICROBIOLOGY, [PMID:39745463] [10.1128/aem.01804-24] |
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