(4S,4aS,5aS,6S,12aS)-2-Acetyl-4-(dimethylamino)-3,6,10,12,12a-pentahydroxy-6-methyl-4a,5a,6,12a-tetrahydrotetracene-1,11(4H,5H)-dione, 95+%

cas: 6542-44-5 — see every product listed under this CAS number, including other names

(4S,4aS,5aS,6S,12aS)-2-Acetyl-4-(dimethylamino)-3,6,10,12,12a-pentahydroxy-6-methyl-4a,5a,6,12a-tetrahydrotetracene-1,11(4H,5H)-dione, 95+% (CAS 6542-44-5) is a chemical reagent available from Chemat. Available pack sizes: on request. Offered by: Chemat Brand.

• 2D
• 3D

(1S,4aR,11S,11aS,12aS)-3-acetyl-1-(dimethylamino)-4,4a,6,7,11-pentahydroxy-11-methyl-1,11a,12,12a-tetrahydrotetracene-2,5-dione (CAS 6542-44-5) is a chemical compound with the molecular formula C23H25NO8 and a molecular weight of 443.4 g/mol. IUPAC name: (1S,4aR,11S,11aS,12aS)-3-acetyl-1-(dimethylamino)-4,4a,6,7,11-pentahydroxy-11-methyl-1,11a,12,12a-tetrahydrotetracene-2,5-dione. InChIKey: VCGJFFLJLRZIHG-OIVQWWNTSA-N.

Identity

Molecular formula	C23H25NO8
Molecular weight	443.4 g/mol
IUPAC name	(1S,4aR,11S,11aS,12aS)-3-acetyl-1-(dimethylamino)-4,4a,6,7,11-pentahydroxy-11-methyl-1,11a,12,12a-tetrahydrotetracene-2,5-dione
InChIKey	VCGJFFLJLRZIHG-OIVQWWNTSA-N
SMILES	CC(=O)C1=C([C@@]2([C@@H](C[C@H]3C(=C(C4=C([C@@]3(C)O)C=CC=C4O)O)C2=O)[C@@H](C1=O)N(C)C)O)O

Computed by PubChem (NCBI)

Synonyms: Adotc cpd, 2-Acetyl-2-decarboxamidooxytetracycline, 2-Acetyl-2-decarboxamido-oxytetracycline, Lymecycline EP Impurity B, Tetracycline EP Impurity B, orb2665399, LYMECYCLINE IMPURITY B [EP IMPURITY], TETRACYCLINE IMPURITY B [EP IMPURITY], Lymecycline EP Impurity B;<br>Tetracycline EP Impurity B, TETRACYCLINE HYDROCHLORIDE IMPURITY B [EP IMPURITY]

Isomers (same molecular formula)

(1S,4aR,11R,11aR,12S,12aR)-3-acetyl-1-(dimethylamino)-4,4a,6,7,12-pentahydroxy-11-methyl-11,11a,12,12a-tetrahydro-1H-tetracene-2,5-dione C₂₃H₂₅NO₈

[(2-formyl-3,4-dimethoxyphenyl)-[(5R)-4-hydroxy-6-methyl-7,8-dihydro-5H-[1,3]dioxolo[4,5-g]isoquinolin-5-yl]methyl] acetate C₂₃H₂₅NO₈

ethyl (4R,4aS,7aR,12bS)-4a,9-diacetyloxy-7-oxo-2,4,5,6,7a,13-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinoline-3-carboxylate C₂₃H₂₅NO₈