Doxycycline D3 Hyclate

Product Name Doxycycline D3 Hyclate
CAT No. CS-O-14377
CAS No. 24390-14-5 (Unlabeled)
Category Stable Isotopes
Stock Enquire
Mol. Wt. 447.45+36.46+18.02+46.07 g/mol
Mol. For. C₂₂H₂₁D₃N₂O₈.HCl .(H₂O).(C₂H₆O)
Hazardous This is a Hazardous Compound
COA View Sample COA
MSDS View Sample MSDS
Smileys CCO.O[C@@](C(O)=C(C(C1=C2C=CC=C1O)=O)[C@]([C@H]2C)([H])[C@@H]3O)(C(C(C(N)=O)=C4O)=O)[C@]3([H])[C@@H]4N(C)C([2H])([2H])[2H].O[C@@](C(O)=C(C(C5=C6C=CC=C5O)=O)[C@]([C@H]6C)([H])[C@@H]7O)(C(C(C(N)=O)=C8O)=O)[C@]7([H])[C@@H]8N(C)C.O.Cl
Canonical Smiles CCO.CC1C2C(C3C(C(=O)C(=C(C3(C(=O)C2=C(C4=C1C=CC=C4O)O)O)O)C(=O)N)N(C)C)O.CC1C2C(C3C(C(=O)C(=C(C3(C(=O)C2=C(C4=C1C=CC=C4O)O)O)O)C(=O)N)N(C)C)O.O.Cl.Cl
InchIKey UHHHTIKWXBRCLT-VDBOFHIQSA-N
Inchl InChI=1S/2C22H24N2O8.C2H6O.2ClH.H2O/c2*1-7-8-5-4-6-9(25)11(8)16(26)12-10(7)17(27)14-15(24(2)3)18(28)13(21(23)31)20(30)22(14,32)19(12)29;1-2-3;;;/h2*4-7,10,14-15,17,25-27,30,32H,1-3H3,(H2,23,31);3H,2H2,1H3;2*1H;1H2/t2*7-,10+,14+,15-,17-,22-;;;;/m00..../s1
IUPAC (4S,4aR,5S,5aR,6R,12aR)-4-(dimethylamino)-1,5,10,11,12a-pentahydroxy-6-methyl-3,12-dioxo-4a,5,5a,6-tetrahydro-4H-tetracene-2-carboxamide;ethanol;hydrate;dihydrochloride
Controlled No
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