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CS-W001157 4
Total: USD 88.00

Methyl (4aS,6aR,6bR,8aR,10S,12aR,12bR,14aR,14bS)-10-acetoxy-2,2,6a,6b,9,9,12a-heptamethyl-14-oxoicosahydropicene-4a(2H)-carboxylate

  • CAS No. 25493-94-1

  • Cat. No. CS-M1465
  • Molecule weight528.76
  • Purity≥98%
  • MDL No.None

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

Methyl (4aS,6aR,6bR,8aR,10S,12aR,12bR,14aR,14bS)-10-acetoxy-2,2,6a,6b,9,9,12a-heptamethyl-14-oxoicosahydropicene-4a(2H)-carboxylate|CS-M1465

Structure of 25493-94-1

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General Information

  • CAS No. 25493-94-1
  • Cat. No. CS-M1465
  • Purity ≥98%
  • MDL No. None
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₃₃H₅₂O₅
  • Molecular Weight 528.76
  • Synonym(s) Methyl (3β,5ξ,9ξ,18α)-3-acetoxy-12-oxooleanan-28-oate
  • SMILES CC(C)([C@]1([H])CC[C@@]([C@@]2(CC[C@]3(CCC(C)(C[C@]3([C@]24[H])[H])C)C(OC)=O)C)5C)[C@@H](OC(C)=O)CC[C@]1(C)[C@@]5([H])CC4=O

Synthesis

  • Route1
    • null|null
      399033-01-3
    • ~94%
    • In-stock
      Methyl (4aS,6aR,6bR,8aR,10S,12aR,12bR,14aR,14bS)-10-acetoxy-2,2,6a,6b,9,9,12a-heptamethyl-14-oxoicosahydropicene-4a(2H)-carboxylate|CS-M1465
      25493-94-1

    References

    • Okamoto, Iwao; Takeya, Tetsuya; Kagawa, Yoshiki; Kotani, Eiichi Chemical and Pharmaceutical Bulletin, 2000 , vol. 48, # 1 p. 120 - 125
  • Route2
    • null|null
      25493-69-0
    • ~38%
    • In-stock
      Methyl (4aS,6aR,6bR,8aR,10S,12aR,12bR,14aR,14bS)-10-acetoxy-2,2,6a,6b,9,9,12a-heptamethyl-14-oxoicosahydropicene-4a(2H)-carboxylate|CS-M1465
      25493-94-1
    • null|null
      15071-78-0

    References

    • Okamoto, Iwao; Takeya, Tetsuya; Kagawa, Yoshiki; Kotani, Eiichi Chemical and Pharmaceutical Bulletin, 2000 , vol. 48, # 1 p. 120 - 125
  • Route3
    • null|null
      25493-69-0
    • ~%
    • In-stock
      Methyl (4aS,6aR,6bR,8aR,10S,12aR,12bR,14aR,14bS)-10-acetoxy-2,2,6a,6b,9,9,12a-heptamethyl-14-oxoicosahydropicene-4a(2H)-carboxylate|CS-M1465
      25493-94-1

    References

    • Zhu, Yong-Ming; Shen, Jing-Kang; Wang, Hui-Kang; Cosentino; Lee, Kuo-Hsiung Bioorganic and Medicinal Chemistry Letters, 2001 , vol. 11, # 24 p. 3115 - 3118

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H302-H315-H319-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P362+P364-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   69.67
  • LogP   7.1517
  • H_Acceptors   5
  • H_Donors   0
  • Rotatable_Bonds   2

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