(4R)-Omadacycline

cas: 601455-29-2 — see every product listed under this CAS number, including other names

(4R)-Omadacycline (CAS 601455-29-2) is a chemical reagent available from Chemat. Available pack sizes: 5mg. Offered by: TRC.

brandTRC
catalog numberTRC-A094875-5MG
cas601455-29-2
size5mg
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properties

purityNo data
delivery timeTo be confirmed by Chemat
Structural formula: {0} (CAS {1})

(4R,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 (CAS 601455-29-2) is a chemical compound with the molecular formula C29H40N4O7 and a molecular weight of 556.6 g/mol. IUPAC name: (4R,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. InChIKey: VJYKVCURWJGLPG-QUJHQXMQSA-N.

Identity
Molecular formulaC29H40N4O7
Molecular weight556.6 g/mol
IUPAC name(4R,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
InChIKeyVJYKVCURWJGLPG-QUJHQXMQSA-N
SMILESCC(C)(C)CNCC1=CC(=C2C[C@H]3C[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

Computed by PubChem (NCBI)

Synonyms: (4R)-Omadacycline, Omadacycline Impurity 9, Omacycline 4-Beta isomer
Related forms of this compound
(4S,4aS,5aR,12aR)-4,7-bis(dimethylamino)-1,10,11,12a-tetrahydroxy-3,12-dioxo-9-[[[3,3,3-trideuterio-2,2-bis(trideuteriomethyl)propyl]amino]methyl]-4a,5,5a,6-tetrahydro-4H-tetracene-2-carboxamide C29H40N4O7
(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 C29H40N4O7