CAS 18695-01-7 Alpha-Apo-oxytetracycline - Analytical Products / Alfa Chemistry

CAT	APS18695017
CAS	18695-01-7
Structure
Synonyms	Oxytetracycline Hydrochloride Imp. D (EP), Alpha-apo-oxytetracycline,(3S,4S,5S)-4-[(1R)-4,5-dihydroxy-9-methyl-3-oxo-1,3-dihydronaphtho[2,3-c]furan-1-yl]-3-(dimethylamino)-2,5-dihydroxy-6-oxocyclohex-1-enecarboxamide
IUPAC Name	(3S,4S,5S)-4-[(1R)-4,5-dihydroxy-9-methyl-3-oxo-1H-benzo[f][2]benzofuran-1-yl]-3-(dimethylamino)-2,5-dihydroxy-6-oxocyclohexene-1-carboxamide
Molecular Weight	442.42
Molecular Formula	C22H22N2O8
Canonical SMILES	CN(C)[C@H]1[C@@H]([C@H](O)C(=O)C(=C1O)C(=O)N)[C@H]2OC(=O)c3c(O)c4c(O)cccc4c(C)c23
InChI	InChI=1S/C22H22N2O8/c1-7-8-5-4-6-9(25)11(8)16(26)12-10(7)20(32-22(12)31)13-15(24(2)3)17(27)14(21(23)30)19(29)18(13)28/h4-6,13,15,18,20,25-28H,1-3H3,(H2,23,30)/t13-,15-,18-,20-/m0/s1

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