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CAS 83038-87-3

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Metaphosphoric acid, sodium salt, compd. with (4S,4aR,5S,5aR,6R,12aS)-4-(dimethylamino)-1,4,4a,5,5a,6,11,12a-octahydro-3,5,10,12,12a-pentahydroxy-6-methyl-1,11-dioxo-2-naphthacenecarboxamide (1:1:3)

Description:
Metaphosphoric acid, sodium salt, is a chemical compound characterized by its unique structure and properties. It is a salt formed from metaphosphoric acid, which is a polymeric form of phosphoric acid. This compound typically exhibits high solubility in water, making it useful in various applications, including analytical chemistry and biochemistry. The presence of sodium ions contributes to its ionic nature, enhancing its reactivity and interaction with other substances. The specific compound you mentioned also contains a complex organic moiety, which suggests potential biological activity or utility in pharmaceuticals. The structural features, including multiple hydroxyl groups and a dioxo group, indicate that it may participate in hydrogen bonding and other intermolecular interactions, influencing its behavior in solution. Overall, this compound's characteristics, including solubility, reactivity, and structural complexity, make it of interest in both research and industrial applications.
Formula:C22H24N2O8H4O12P4Na
InChI:InChI=1S/C22H24N2O8.Na.H4O12P4/c1-7-8-5-4-6-9(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;;1-13(2)9-14(3,4)11-16(7,8)12-15(5,6)10-13/h4-7,10,14-15,17,25,27-29,32H,1-3H3,(H2,23,31);;(H,1,2)(H,3,4)(H,5,6)(H,7,8)/t7-,10+,14+,15-,17-,22-;;/m0../s1
InChI key:InChIKey=JGIZUKDXWRYLNA-QFWOMMJSSA-N
SMILES:O=P1(O)OP(=O)(O)OP(=O)(O)OP(=O)(O)O1.O[C@]12[C@]([C@H](N(C)C)C(O)=C(C(N)=O)C1=O)([C@@H](O)[C@]3(C(=C2O)C(=O)C=4C([C@@H]3C)=CC=CC4O)[H])[H].[Na]
Synonyms:
  • Metaphosphoric acid (H4P4O12), monosodium salt, compd. with (4S,4aR,5S,5aR,6R,12aS)-4-(dimethylamino)-1,4,4a,5,5a,6,11,12a-octahydro-3,5,10,12,12a-pentahydroxy-6-methyl-1,11-dioxo-2-naphthacenecarboxamide (1:3)
  • 2-Naphthacenecarboxamide, 4-(dimethylamino)-1,4,4a,5,5a,6,11,12a-octahydro-3,5,10,12,12a-pentahydroxy-6-methyl-1,11-dioxo-, [4S-(4α,4aα,5α,5aα,6α,12aα)]-, compd. with metaphosphoric acid (H4P4O12) monosodium salt (3:1)
  • Metaphosphoric acid (H4P4O12), monosodium salt, compd. with [4S-(4α,4aα,5α,5aα,6α,12aα)]-4-(dimethylamino)-1,4,4a,5,5a,6,11,12a-octahydro-3,5,10,12,12a-pentahydroxy-6-methyl-1,11-dioxo-2-naphthacenecarboxamide (1:3)
  • Metaphosphoric acid, sodium salt, compd. with (4S,4aR,5S,5aR,6R,12aS)-4-(dimethylamino)-1,4,4a,5,5a,6,11,12a-octahydro-3,5,10,12,12a-pentahydroxy-6-methyl-1,11-dioxo-2-naphthacenecarboxamide (1:1:3)
  • 2-Naphthacenecarboxamide, 4-(dimethylamino)-1,4,4a,5,5a,6,11,12a-octahydro-3,5,10,12,12a-pentahydroxy-6-methyl-1,11-dioxo-, (4S,4aR,5S,5aR,6R,12aS)-, compd. with metaphosphoric acid (H4P4O12) monosodium salt (3:1)
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