Germerine

Catalog No. :
ACQTJU502
CAS No. :
508-67-8
Molecular Formula :
C37H59NO11
Molecular Weight :
693.88

IUPAC Name:(3S,4S,4aS,6R,6aS,6bS,7S,8R,8aR,9S,9aS,12S,15aS,15bS,16aR,16bS)-4,6,6b,8,9-pentahydroxy-9,12,16b-trimethyl-7-((2-methylbutanoyl)oxy)docosahydro-2H-4,16a-epoxybenzo[4,5]indeno[1,2-h]pyrido[1,2-b]isoquinolin-3-yl 2-hydroxy-2-methylbutanoate

Germerine structure diagram
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Product Information

Product NameGermerine
IUPAC Name(3S,4S,4aS,6R,6aS,6bS,7S,8R,8aR,9S,9aS,12S,15aS,15bS,16aR,16bS)-4,6,6b,8,9-pentahydroxy-9,12,16b-trimethyl-7-((2-methylbutanoyl)oxy)docosahydro-2H-4,16a-epoxybenzo[4,5]indeno[1,2-h]pyrido[1,2-b]isoquinolin-3-yl 2-hydroxy-2-methylbutanoate
Molecular FormulaC37H59NO11
Molecular Weight693.88
SMILESCCC(C)C(=O)O[C@H]1[C@H](O)[C@H]2[C@@H](CN3C[C@@H](C)CC[C@H]3[C@@]2(C)O)[C@@H]2C[C@]34O[C@]5(O)[C@@H](OC(=O)C(C)(O)CC)CC[C@@]3(C)[C@@H]5C[C@@H](O)[C@H]4[C@@]21O
InChI KeyJOBMMOBXVRRLOS-GIQIJVODSA-N
Synonym4α,9-Epoxycevane-3β,4,7α,14,15α,16β,20-heptol 3-[(S)-2-hydroxy-2-methylbutanoate]15-[(R)-2-methylbutanoate];germerine;Cevane-3,4,7,14,15,16,20-heptol, 4,9-epoxy-, 3-[(2S)-2-hydroxy-2-methylbutanoate] 15-[(2R)-2-methylbutanoate], (3β,4α,7α,15α,16β)-
CAS No.508-67-8

Synthetic Route by SureRoute

1. ACQTJU502 Molecular Building Block Synthetic Route

Source: SureRouteAuthor: aifchem

  1. reactant_1 route compound structure diagram
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  2. Plus
  3. reactant_2 route compound structure diagram
    --
  4. Then
  5. ACQTJU502 route product structure diagram
    ACQTJU502508-67-8
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2. ACQTJU502 Molecular Building Block Synthetic Route

Source: SureRouteAuthor: aifchem

  1. reactant_1 route compound structure diagram
    --
  2. Plus
  3. ACDUBI165 route compound structure diagram
    ACDUBI1654033-83-4 In Stock
  4. Then
  5. ACQTJU502 route product structure diagram
    ACQTJU502508-67-8
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