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CS-W001157 4
Total: USD 88.00

Digitoxigenin

  • CAS No. 143-62-4

  • Cat. No. CS-0020303
  • Purity≥98%
  • MDL No.None

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

Digitoxigenin|CS-0020303

Structure of 143-62-4

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General Information

  • CAS No. 143-62-4
  • Cat. No. CS-0020303
  • Purity ≥98%
  • MDL No. None
  • Storage 4°C, sealed storage, away from moisture and light
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₂₃H₃₄O₄
  • Molecular Weight 374.51
  • Synonym(s) Cerberigenin; Echujetin
  • SMILES O[C@@]12[C@@]3([H])[C@@](CC[C@@]1([C@@H](C(CO4)=CC4=O)CC2)C)([H])[C@@]5([C@](C[C@H](CC5)O)([H])CC3)C

Description

Hippuric acid, the glycine conjugate of benzoic acid, is formed via a biotransformation process. From scientific literature, it is reported to be found as an excretory product in urine. Hippuric acid is also known to be catabolically synthesized from benzene-type aromatic compounds, believed to be originated from various factors such as environmental exposures, basic human liver metabolism of protein catabolism, cyclic sugar type-compounds, quinic acid, etc.Hippuric acid may be used as an analytical reference standard for the quantification of the analyte in the following:Human biological fluids using high-performance liquid chromatography (HPLC) with UV detection.Human and rat urine samples using gas chromatographymass spectrometry (GCMS).Human urine samples using GC equipped with a flame ionization detector.

Synthesis

  • Route1

    References

    • Ma, Yuyong; Li, Zhongzhen; Shi, Hefang; Zhang, Jian; Yu, Biao Journal of Organic Chemistry, 2011 , vol. 76, # 23 p. 9748 - 9756
  • Route2
    • null|null
      182573-64-4
    • ~98%
    • In-stock
      Digitoxigenin|CS-0020303
      143-62-4

    References

    • Stork, Gilbert; West, Fred; Lee, Hee Yoon; Isaacs, Richard C. A.; Manabe, Shino Journal of the American Chemical Society, 1996 , vol. 118, # 43 p. 10660 - 10661
  • Route3
    • null|null
      809-98-3
    • ~87%
    • In-stock
      Digitoxigenin|CS-0020303
      143-62-4

    References

    • Daniewski, Andrzej Robert; Kabat, Marek Michal; Masnyk, Marek; Wojciechowska, Wanda; Wicha, Jerzy Collection of Czechoslovak Chemical Communications, 1991 , vol. 56, # 5 p. 1064 - 1069

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS06
Signal Word : Danger
UN#: 3462
Class : 6.1
Packing Group : Ⅱ
Hazard Statements : H300
Precautionary Statements : P264-P270-P330-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   66.76
  • LogP   3.6043
  • H_Acceptors   4
  • H_Donors   2
  • Rotatable_Bonds   1

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