Demeclocycline EP Impurity E

cas: 4496-85-9 — see every product listed under this CAS number, including other names

Demeclocycline EP Impurity E (CAS 4496-85-9) is a chemical reagent available from Chemat. Available pack sizes: on request. Offered by: Chemat Brand.

brandChemat Brand
catalog numberRM-D130305
cas4496-85-9
sizeon request
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Structural formula: {0} (CAS {1})

(4S,4aS,12aR)-4-(dimethylamino)-1,10,11,12a-tetrahydroxy-3,12-dioxo-4a,5-dihydro-4H-tetracene-2-carboxamide (CAS 4496-85-9) is a chemical compound with the molecular formula C21H20N2O7 and a molecular weight of 412.4 g/mol. IUPAC name: (4S,4aS,12aR)-4-(dimethylamino)-1,10,11,12a-tetrahydroxy-3,12-dioxo-4a,5-dihydro-4H-tetracene-2-carboxamide. InChIKey: MKMODNONNZFRNH-QYAMTVPHSA-N.

Identity
Molecular formulaC21H20N2O7
Molecular weight412.4 g/mol
IUPAC name(4S,4aS,12aR)-4-(dimethylamino)-1,10,11,12a-tetrahydroxy-3,12-dioxo-4a,5-dihydro-4H-tetracene-2-carboxamide
InChIKeyMKMODNONNZFRNH-QYAMTVPHSA-N
SMILESCN(C)[C@H]1[C@@H]2CC3=C(C(=C4C(=C3)C=CC=C4O)O)C(=O)[C@@]2(C(=C(C1=O)C(=O)N)O)O

Computed by PubChem (NCBI)

Synonyms: Anhydro-6-demethyltetracycline, Demeclocycline EP Impurity E, Anhydrodemethyltetracycline
Isomers (same molecular formula)
(2S,3S,4S,5R)-6-(benzo[b][1]benzazepine-11-carbonylamino)-3,4,5-trihydroxyoxane-2-carboxylic acid C21H20N2O7

Also listed as

Anhydrodemethyltetracycline TRC CAS 4496-85-9