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CAS 64058-48-6

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4H-Pyrano[2,3-b][1,4]benzodioxin-4-one, decahydro-4a,7,9-trihydroxy-2-methyl-6,8-bis(methylamino)-, [2R-(2α,4aβ,5aβ,6β,7β,8β,9α,9aα,10aβ)]-, sulfate (1:1) (salt), tetrahydrate

Description:
4H-Pyrano[2,3-b][1,4]benzodioxin-4-one, decahydro-4a,7,9-trihydroxy-2-methyl-6,8-bis(methylamino)-, is a complex organic compound characterized by its unique bicyclic structure that incorporates both a pyran and benzodioxin moiety. This compound features multiple hydroxyl groups, which contribute to its potential solubility in polar solvents and may influence its biological activity. The presence of methylamino groups suggests that it may exhibit basic properties, potentially allowing for interactions with various biological targets. As a sulfate salt, it is likely to be more soluble in aqueous environments, enhancing its bioavailability. The tetrahydrate form indicates that the compound can associate with water molecules, which may affect its stability and reactivity. Overall, this compound's intricate structure and functional groups suggest potential applications in medicinal chemistry, particularly in the development of pharmaceuticals, though specific biological activities would require further investigation.
Formula:C14H24N2O7·H2O4S·4H2O
InChI:InChI=1S/C14H24N2O7.H2O4S.H2O/c1-5-4-6(17)14(20)13(21-5)22-12-10(19)7(15-2)9(18)8(16-3)11(12)23-14;1-5(2,3)4;/h5,7-13,15-16,18-20H,4H2,1-3H3;(H2,1,2,3,4);1H2/t5-,7-,8+,9+,10+,11-,12-,13+,14+;;/m1../s1
InChI key:InChIKey=XPEBEPHQVRGNCX-XYQGXRRISA-N
SMILES:S(=O)(=O)(O)O.N(C)[C@@H]1[C@@]2([C@](O[C@]3([C@@](O)(O2)C(=O)C[C@@H](C)O3)[H])([C@@H](O)[C@H](NC)[C@@H]1O)[H])[H].O
Synonyms:
  • (2R,4aR,5aR,6S,7S,8R,9S,9aR,10aS)-4a,7,9-trihydroxy-2-methyl-6,8-bis(methylamino)decahydro-4H-pyrano[2,3-b][1,4]benzodioxin-4-one sulfate hydrate (1:1:4)
  • 4H-Pyrano[2,3-b][1,4]benzodioxin-4-one, decahydro-4a,7,9-trihydroxy-2-methyl-6,8-bis(methylamino)-, [2R-(2α,4aβ,5aβ,6β,7β,8β,9α,9aα,10aβ)]-, sulfate (1:1) (salt), tetrahydrate
  • Actinospectacin, tetrahydrate, sulfate
  • Spectinomycin, tetrahydrate, sulfate
  • Trobicin sulfate
  • U-18409E
  • Unii-Ys91P54918
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