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CS-W001157 4
Total: USD 88.00

1H,5H-Cyclopenta[f][1,2,4]triazolo[1,2-a]cinnoline-1,3(2H)-dione, 11-(3,5-dihydroxy-2-methyl-1-cyclohexen-1-yl)-4a,6,6a,7,8,9,9a,11-octahydro-7-(5-hydroxy-1,5-dimethylhexyl)-6a-methyl-2-phenyl-, [4aR-[4aα,6aα,7α(R*),9aβ,11α(3S*,5R*)]]-

  • CAS No. 86307-44-0

  • Cat. No. CS-0655222
  • Purity≥98%
  • MDL No.None

*For research and further manufacturing use only, not for direct human use.

1H,5H-Cyclopenta[f][1,2,4]triazolo[1,2-a]cinnoline-1,3(2H)-dione, 11-(3,5-dihydroxy-2-methyl-1-cyclohexen-1-yl)-4a,6,6a,7,8,9,9a,11-octahydro-7-(5-hydroxy-1,5-dimethylhexyl)-6a-methyl-2-phenyl-, [4aR-[4aα,6aα,7α(R*),9aβ,11α(3S*,5R*)]]-|CS-0655222

Structure of 86307-44-0

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General Information

  • CAS No. 86307-44-0
  • Cat. No. CS-0655222
  • Purity ≥98%
  • MDL No. None
  • Storage 4°C, protect from light
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₃₅H₄₉N₃O₅
  • Molecular Weight 591.78
  • Synonym(s) None
  • SMILES C[C@@]12[C@](CC[C@@H]2[C@@H](CCCC(C)(C)O)C)([H])C(C(N(C(N3C4=CC=CC=C4)=O)N5C3=O)CC1)=CC5C6=C(C)[C@@H](O)C[C@H](O)C6

Synthesis

  • Route1
    • null|null
      86307-43-9
    • ~73%
    • In-stock
      1H,5H-Cyclopenta[f][1,2,4]triazolo[1,2-a]cinnoline-1,3(2H)-dione, 11-(3,5-dihydroxy-2-methyl-1-cyclohexen-1-yl)-4a,6,6a,7,8,9,9a,11-octahydro-7-(5-hydroxy-1,5-dimethylhexyl)-6a-methyl-2-phenyl-, [4aR-[4aα,6aα,7α(R*),9aβ,11α(3S*,5R*)]]-|CS-0655222
      86307-44-0

    References

    • Vanmaele, L.; Clerq, P. J. de; Vandewalle, M. Tetrahedron, 1985 , vol. 41, # 1 p. 141 - 144
  • Route2

    References

    • Tetrahedron, , vol. 41, # 1 p. 141 - 144
  • Route3
    • null|null
      23357-18-8
    • ~%
    • In-stock
      1H,5H-Cyclopenta[f][1,2,4]triazolo[1,2-a]cinnoline-1,3(2H)-dione, 11-(3,5-dihydroxy-2-methyl-1-cyclohexen-1-yl)-4a,6,6a,7,8,9,9a,11-octahydro-7-(5-hydroxy-1,5-dimethylhexyl)-6a-methyl-2-phenyl-, [4aR-[4aα,6aα,7α(R*),9aβ,11α(3S*,5R*)]]-|CS-0655222
      86307-44-0

    References

    • Tetrahedron, , vol. 41, # 1 p. 141 - 144

Safety Information

Download SDS
GHS Pictogram : N/A
GHS No : N/A
Signal Word : N/A
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : N/A
Precautionary Statements : N/A

Quality Control

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Computational Chemistry Data

  • TPSA   109.62
  • LogP   5.0586
  • H_Acceptors   8
  • H_Donors   3
  • Rotatable_Bonds   7

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