(4S,4AS,12aS)-4,7-Bis(dimethylamino)-3,10,11,… 2272886-35-6

Name: (4S,4AS,12aS)-4,7-Bis(dimethylamino)-3,10,11,12a-tetrahydroxy-9-((neopentylamino)methyl)-1,12-dioxo-1,4,4a,5,12,12a-hexahydrotetracene-2-carboxamide
Brand: Vaqora Chemicals
SKU: VQ-032255

About (4S,4AS,12aS)-4,7-Bis(dimethylamino)-3,10,11,12a-tetrahydroxy-9-((neopentylamino)methyl)-1,12-dioxo-1,4,4a,5,12,12a-hexahydrotetracene-2-carboxamide

(4S,4AS,12aS)-4,7-Bis(dimethylamino)-3,10,11,12a-tetrahydroxy-9-((neopentylamino)methyl)-1,12-dioxo-1,4,4a,5,12,12a-hexahydrotetracene-2-carboxamide (CAS 2272886-35-6) is a metabolite or degradation product of Omadacycline offered by Vaqora Chemicals. Its molecular formula is C29H38N4O7 and its molecular weight is 554.6 g/mol.

The product is provided as a solid. Reference materials should be stored sealed and away from light and moisture, as specified on the accompanying COA. Good laboratory practice and suitable PPE are recommended during handling.

It is used in metabolite identification, stability-indicating method development and impurity profiling of Omadacycline, as well as in QC testing and ANDA/DMF documentation. Our customers for this product work in pharmaceutical manufacturing and academic and industrial research.

Vaqora Chemicals supplies (4S,4AS,12aS)-4,7-Bis(dimethylamino)-3,10,11,12a-tetrahydroxy-9-((neopentylamino)methyl)-1,12-dioxo-1,4,4a,5,12,12a-hexahydrotetracene-2-carboxamide in 10 mg, 25 mg, 50 mg and 100 mg packs, each shipped with a Certificate of Analysis (COA), and exports worldwide.

Typical applications

Metabolite identification
Stability-indicating methods
Impurity profiling

Industries

Related to Omadacycline

View every impurity, metabolite and intermediate we list for Omadacycline.

Omadacycline impurities

Specifications & identifiers

Chemical identifiers
Product name	(4S,4AS,12aS)-4,7-Bis(dimethylamino)-3,10,11,12a-tetrahydroxy-9-((neopentylamino)methyl)-1,12-dioxo-1,4,4a,5,12,12a-hexahydrotetracene-2-carboxamide
Catalogue No.	VQ-032255
CAS Number	2272886-35-6
IUPAC name	(4S,4aS,12aR)-4,7-bis(dimethylamino)-9-[(2,2-dimethylpropylamino)methyl]-1,10,11,12a-tetrahydroxy-3,12-dioxo-4a,5-dihydro-4H-tetracene-2-carboxamide
Molecular formula	C₂₉H₃₈N₄O₇
Molecular weight	554.6 g/mol
Exact mass	554.274
Grade	Reference Standard
HSN code	38229090
InChIKey	BSKBWHHKUMKJAN-LYSGHTCPSA-N
SMILES	CC(C)(C)CNCC1=CC(=C2C=C3C[C@H]4[C@@H](C(=O)C(=C([C@]4(C(=O)C3=C(C2=C1O)O)O)O)C(=O)N)N(C)C)N(C)C
PubChem CID	59311366

Physical properties
Physical form	Solid
LogP (XLogP3)	3.8
H-bond donors / acceptors	6 / 10
TPSA	177 Å²

Documents

Safety Data Sheet (SDS)16-section GHS · on request Certificate of AnalysisTypical / batch COA · on request Specification sheetTDS / MOA · on request

Frequently asked questions

What is the CAS number of (4S,4AS,12aS)-4,7-Bis(dimethylamino)-3,10,11,12a-tetrahydroxy-9-((neopentylamino)methyl)-1,12-dioxo-1,4,4a,5,12,12a-hexahydrotetracene-2-carboxamide?

The CAS Registry Number of (4S,4AS,12aS)-4,7-Bis(dimethylamino)-3,10,11,12a-tetrahydroxy-9-((neopentylamino)methyl)-1,12-dioxo-1,4,4a,5,12,12a-hexahydrotetracene-2-carboxamide is 2272886-35-6.

What is the molecular formula and molecular weight of (4S,4AS,12aS)-4,7-Bis(dimethylamino)-3,10,11,12a-tetrahydroxy-9-((neopentylamino)methyl)-1,12-dioxo-1,4,4a,5,12,12a-hexahydrotetracene-2-carboxamide?

(4S,4AS,12aS)-4,7-Bis(dimethylamino)-3,10,11,12a-tetrahydroxy-9-((neopentylamino)methyl)-1,12-dioxo-1,4,4a,5,12,12a-hexahydrotetracene-2-carboxamide has the molecular formula C29H38N4O7 and a molecular weight of 554.6 g/mol. Its IUPAC name is (4S,4aS,12aR)-4,7-bis(dimethylamino)-9-[(2,2-dimethylpropylamino)methyl]-1,10,11,12a-tetrahydroxy-3,12-dioxo-4a,5-dihydro-4H-tetracene-2-carboxamide.

What is (4S,4AS,12aS)-4,7-Bis(dimethylamino)-3,10,11,12a-tetrahydroxy-9-((neopentylamino)methyl)-1,12-dioxo-1,4,4a,5,12,12a-hexahydrotetracene-2-carboxamide used for?

(4S,4AS,12aS)-4,7-Bis(dimethylamino)-3,10,11,12a-tetrahydroxy-9-((neopentylamino)methyl)-1,12-dioxo-1,4,4a,5,12,12a-hexahydrotetracene-2-carboxamide is supplied as a characterised reference material related to Omadacycline. It is used for analytical method development and validation (AMV), impurity profiling, stability studies and quality control, and in ANDA/DMF regulatory filings.

Which grade and pack sizes of (4S,4AS,12aS)-4,7-Bis(dimethylamino)-3,10,11,12a-tetrahydroxy-9-((neopentylamino)methyl)-1,12-dioxo-1,4,4a,5,12,12a-hexahydrotetracene-2-carboxamide can I order?

We supply (4S,4AS,12aS)-4,7-Bis(dimethylamino)-3,10,11,12a-tetrahydroxy-9-((neopentylamino)methyl)-1,12-dioxo-1,4,4a,5,12,12a-hexahydrotetracene-2-carboxamide in Reference Standard grade, in 10 mg, 25 mg, 50 mg, 100 mg packs. Larger bulk quantities and custom packing are quoted on request.

Do you provide a COA and SDS with (4S,4AS,12aS)-4,7-Bis(dimethylamino)-3,10,11,12a-tetrahydroxy-9-((neopentylamino)methyl)-1,12-dioxo-1,4,4a,5,12,12a-hexahydrotetracene-2-carboxamide?

Yes. Every lot of (4S,4AS,12aS)-4,7-Bis(dimethylamino)-3,10,11,12a-tetrahydroxy-9-((neopentylamino)methyl)-1,12-dioxo-1,4,4a,5,12,12a-hexahydrotetracene-2-carboxamide is shipped with a batch-specific Certificate of Analysis, and a 16-section GHS Safety Data Sheet is provided with the quotation and the shipment.

Can (4S,4AS,12aS)-4,7-Bis(dimethylamino)-3,10,11,12a-tetrahydroxy-9-((neopentylamino)methyl)-1,12-dioxo-1,4,4a,5,12,12a-hexahydrotetracene-2-carboxamide be shipped internationally?

Yes. We export (4S,4AS,12aS)-4,7-Bis(dimethylamino)-3,10,11,12a-tetrahydroxy-9-((neopentylamino)methyl)-1,12-dioxo-1,4,4a,5,12,12a-hexahydrotetracene-2-carboxamide worldwide by air and sea freight or express courier, on EXW, FOB, CIF, CFR or DAP Incoterms, with full export documentation.