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AOB8700
CAS: 1075240-43-5
Chemical Name: PTK-0796; (4S,4aS,5aR,12aR)-4,7-Bis(dimethylamino)-9-[(2,2-dimethylpropylamino)methyl]-1,10,11,12a-tetrahydroxy-3,12-dioxo-4a,5,5a,6-tetrahydro-4H-tetracene-2-carboxamide;4-methylbenzenesulfonic acid
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Quantity | mg | Unit Price ($/mg or $/Unit) | Final Price |
---|---|---|---|
1 | 100 | $58.05 | Total: $5,805.00 |
1 | 50 | $67.08 | Total: $3,354.00 |
1 | 25 | $78.69 | Total: $1,967.25 |
1 | 10 | $92.88 | Total: $928.80 |
1 | 5 | $109.65 | Total: $548.25 |
Molecular Formula | C36H48N4O10S |
Molecular Weight | 728.85 |
CAS Numbers | 1075240-43-5 |
Storage Condition | 0°C (short term), -20°C (long term), desiccated |
Solubility | DMSO and Alcohol |
Purity | 98% by HPLC |
Synonym | PTK 0796; PTK-0796; PTK0796; Amadacyclin; Omadacycline; Nuzyra. |
IUPAC/Chemical Name | (4S,4aS,5aR,12aR)-4,7-Bis(dimethylamino)-9-[(2,2-dimethylpropylamino)methyl]-1,10,11,12a-tetrahydroxy-3,12-dioxo-4a,5,5a,6-tetrahydro-4H-tetracene-2-carboxamide;4-methylbenzenesulfonic acid |
InChl Key | JEECQCWWSTZDCK-IQZGDKDPSA-N |
InChl Code | InChI=1S/C29H40N4O7/c1-28(2,3)12-31-11-14-10-17(32(4)5)15-8-13-9-16-21(33(6)7)24(36)20(27(30)39)26(38)29(16,40)25(37)18(13)23(35)19(15)22(14)34/h10,13,16,21,31,34,36-37,40H,8-9,11-12H2,1-7H3,(H2,30,39)/t13-,16-,21-,29-/m0/s1 |
SMILES Code | O=C(C1=C(O)[C@@H](N(C)C)[C@@] |
References | 1) Kovacs SJ, Ting L, Praestgaard J, Sunkara G, Sun H, Stein DS, Tanaka SK, Villano S. An Open-Label Study of the Impact of Hepatic Impairment on the Pharmacokinetics and Safety of Single Oral and Intravenous Doses of Omadacycline. Antimicrob Agents Chemother. 2020 Aug 24:AAC.01650-20. doi: 10.1128/AAC.01650-20. Epub ahead of print. PMID: 32839218. 2) McKenna M. The antibiotic paradox: why companies can't afford to create life- saving drugs. Nature. 2020 Aug;584(7821):338-341. doi: 10.1038/d41586-020-02418-x. PMID: 32814891. |
First-in-class aminomethylcycline antibiotic with a broad spectrum of activity against Gram-positive and Gram-negative aerobes and anaerobes, and atypical bacterial pathogens, binding almost exclusively to the muscarinic-2 (M2) subtype acetylcholine receptor and in the SA node model, antagonizing the effect of a pan-muscarinic agonist (carbamylcholine) in a concentration-dependent manner