(2'R,3R,3aR,4aR,6R,8aR,9aR)-3-((Dimethylamino)methyl)-6-hydroxy-8a-methyldecahydro-2H-spiro[naphtho[2,3-b]furan-5,2'-oxiran]-2-one fumarate

Catalog No. :
ACGAVB290
CAS No. :
2226729-41-3
Molecular Formula :
C21H31NO8
Molecular Weight :
425.48

IUPAC Name:(3R,3aR,4aR,5R,6R,8aR,9aR)-3-((dimethylamino)methyl)-6-hydroxy-8a-methyldecahydro-2H-spiro[naphtho[2,3-b]furan-5,2'-oxiran]-2-one fumarate

(2'R,3R,3aR,4aR,6R,8aR,9aR)-3-((Dimethylamino)methyl)-6-hydroxy-8a-methyldecahydro-2H-spiro[naphtho[2,3-b]furan-5,2'-oxiran]-2-one fumarate structure diagram
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Product Information

Product Name(2'R,3R,3aR,4aR,6R,8aR,9aR)-3-((Dimethylamino)methyl)-6-hydroxy-8a-methyldecahydro-2H-spiro[naphtho[2,3-b]furan-5,2'-oxiran]-2-one fumarate
IUPAC Name(3R,3aR,4aR,5R,6R,8aR,9aR)-3-((dimethylamino)methyl)-6-hydroxy-8a-methyldecahydro-2H-spiro[naphtho[2,3-b]furan-5,2'-oxiran]-2-one fumarate
Molecular FormulaC21H31NO8
Molecular Weight425.48
SMILESO=C([C@H]1CN(C)C)O[C@]([C@]1([H])C2)([H])C[C@]3(C)[C@]2([H])[C@@]4(CO4)[C@H](O)CC3.O=C(/C=C/C(O)=O)O
InChI KeyPJORGLBDGJWULN-BZTSXMDYSA-N
Synonym(3As,4aS,5R,8aR,9aS)-3-[(dimethylamino)methyl]-6-hydroxy-8a-methylspiro[3a,4,4a,6,7,8,9,9a-octahydro-3H-benzo[f][1]benzofuran-5,2'-oxirane]-2-one;(3R,3Ar,4aR,5R,6R,8aR,9aR)-3-[(dimethylamino)methyl]-6-hydroxy-8a-methylspiro[3a,4,4a,6,7,8,9,9a-octahydro-3H-benzo[f][1]benzofuran-5,2'-oxirane]-2-one
CAS No.2226729-41-3

Synthetic Route by SureRoute

1. ACGAVB290 Molecular Building Block Synthetic Route

Source: SureRouteAuthor: aifchem

  1. reactant_1 route compound structure diagram
    --
  2. Then
  3. ACGAVB290 route product structure diagram
    ACGAVB2902226729-41-3
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2. ACGAVB290 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. ACGAVB290 route product structure diagram
    ACGAVB2902226729-41-3
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