Hyponine e

Catalog No. :
ACINDI617
CAS No. :
226975-99-1
Molecular Formula :
C45H48N2O19
Molecular Weight :
920.87

IUPAC Name:(52R,53S,54R,55S,55aR,56R,57R,58S,59S,59aS,510R,8S)-55a-(acetoxymethyl)-510-((furan-2-carbonyl)oxy)-59-hydroxy-52,59,8-trimethyl-54-(nicotinoyloxy)-2,7-dioxo-53,54,55,55a,56,57,58,59-octahydro-52H-3,6-dioxa-1(3,2)-pyridina-5(2,8)-3,9a-methanobenzo[b]oxepinacyclodecaphane-55,56,57-triyl triacetate

Hyponine e structure diagram
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Product Information

Product NameHyponine e
IUPAC Name(52R,53S,54R,55S,55aR,56R,57R,58S,59S,59aS,510R,8S)-55a-(acetoxymethyl)-510-((furan-2-carbonyl)oxy)-59-hydroxy-52,59,8-trimethyl-54-(nicotinoyloxy)-2,7-dioxo-53,54,55,55a,56,57,58,59-octahydro-52H-3,6-dioxa-1(3,2)-pyridina-5(2,8)-3,9a-methanobenzo[b]oxepinacyclodecaphane-55,56,57-triyl triacetate
MDL No.-
Molecular FormulaC45H48N2O19
Molecular Weight920.87
SMILESCC(=O)OC[C@]12[C@H](OC(C)=O)[C@H](OC(=O)C3=CN=CC=C3)[C@H]3[C@@H](OC(=O)C4=CC=CO4)[C@@]14O[C@@]3(C)COC(=O)C1=CC=CN=C1CC[C@H](C)C(=O)O[C@@H]([C@H](OC(C)=O)[C@@H]2OC(C)=O)[C@]4(C)O
InChI KeyVJZFNGPUNWIJDF-GZWHRQHASA-N
SynonymHyponine E;3-Pyridinecarboxylic acid, (8R,9R,10R,11S,12R,13R,14R,15S,20S,21S,22R)-13,14,21-tris(acetyloxy)-12-[(acetyloxy)methyl]-10-[(2-furanylcarbonyl)oxy]-5,7,8,9,10,12,13,14,15,17,18,19-dodecahydro-20-hydroxy-8,18,19,20-tetramethyl-5,17-dioxo-8,11-epoxy-9,12-ethano-11,15-methano-11H-[1,8]dioxacycloheptadec...
CAS No.226975-99-1
PubChem CID44583772

Synthetic Route by SureRoute

1. ACINDI617 Molecular Building Block Synthetic Route

Source: SureRouteAuthor: aifchem

  1. reactant_1 route compound structure diagram
    --
  2. Then
  3. ACINDI617 route product structure diagram
    ACINDI617226975-99-1
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2. ACINDI617 Molecular Building Block Synthetic Route

Source: SureRouteAuthor: aifchem

  1. reactant_1 route compound structure diagram
    --
  2. Plus
  3. reactant_2 route compound structure diagram
    --
  4. Then
  5. ACINDI617 route product structure diagram
    ACINDI617226975-99-1
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