7α-O-Ethylmorroniside

Catalog No. :
ACFBMZ253
CAS No. :
1116650-29-3
Molecular Formula :
C19H30O11
Molecular Weight :
434.44

IUPAC Name:methyl (1S,3S,4aS,8S,8aS)-3-ethoxy-1-methyl-8-(((2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)-4,4a,8,8a-tetrahydro-1H,3H-pyrano[3,4-c]pyran-5-carboxylate

7α-O-Ethylmorroniside structure diagram
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Product Information

Product Name7α-O-Ethylmorroniside
IUPAC Namemethyl (1S,3S,4aS,8S,8aS)-3-ethoxy-1-methyl-8-(((2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)-4,4a,8,8a-tetrahydro-1H,3H-pyrano[3,4-c]pyran-5-carboxylate
Molecular FormulaC19H30O11
Molecular Weight434.44
SMILESO=C(C1=CO[C@@H](O[C@H]2[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)O2)[C@]3([H])[C@H](C)O[C@H](OCC)C[C@@]31[H])OC
InChI KeyIRKFOLIBBQDADK-HWCWTJPSSA-N
Synonym1H,3H-Pyrano[3,4-c]pyran-5-carboxylic acid, 3-ethoxy-8-(β-D-glucopyranosyloxy)-4,4a,8,8a-tetrahydro-1-methyl-, methyl ester, (1S,3S,4aS,8S,8aS)-;7α-O-Ethylmorroniside
CAS No.1116650-29-3

Synthetic Route by SureRoute

1. ACFBMZ253 Molecular Building Block Synthetic Route

Source: SureRouteAuthor: aifchem

  1. ACTRMX927 route compound structure diagram
    ACTRMX927555-75-9
  2. Plus
  3. reactant_2 route compound structure diagram
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  4. Then
  5. ACFBMZ253 route product structure diagram
    ACFBMZ2531116650-29-3
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2. ACFBMZ253 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. ACFBMZ253 route product structure diagram
    ACFBMZ2531116650-29-3
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