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25269-17-4

25269-17-4 structure
25269-17-4 structure
  • Name: ISOCEMBROL
  • Chemical Name: (1R,2E,4S,7E,11E)-4-Isopropyl-1,7,11-trimethyl-2,7,11-cyclotetrad ecatrien-1-ol
  • CAS Number: 25269-17-4
  • Molecular Formula: C20H34O
  • Molecular Weight: 290.48300
  • Catalog: Research Areas Inflammation/Immunology
  • Create Date: 2017-10-24 09:18:06
  • Modify Date: 2024-01-02 15:06:02
  • Thunbergol (Isocembrol) (Compound 17) is a potent TNF-α inhibitor with an IC50 of 7.2 μM[1].

Name (1R,2E,4S,7E,11E)-4-Isopropyl-1,7,11-trimethyl-2,7,11-cyclotetrad ecatrien-1-ol
Synonyms 1H-3a,7-Methanoazulen-5(4H)-one,hexahydro-3,6,8,8-tetramethyl-,(3R,3aR,6S,7S,8aS)
CEDRALON
isocedranone
Cedralone
3,6,8,8-Tetramethylhexahydro-1H-3a,7-methanoazulene-5(4H)-one
(3R-(3alpha,3Abeta,6alpha,7beta,8aalpha))-hexahydro-3,6,8,8-tetramethyl-1H-3A,7-methanoazulen-5(4H)-one
2-Isocedranone
Cedran-9-one
9-Cedranone
Isocembrol (4R)
Description Thunbergol (Isocembrol) (Compound 17) is a potent TNF-α inhibitor with an IC50 of 7.2 μM[1].
Related Catalog
Target

TNF-α:7.2 μM (IC50)

References

[1]. Li G, et al. Further polyoxygenated cembranoids from South China Sea soft coral Sarcophyton ehrenbergi. Bioorg Chem. 2020 Aug;101:103993.

Density 0.876g/cm3
Boiling Point 392.69ºC at 760 mmHg
Molecular Formula C20H34O
Molecular Weight 290.48300
Flash Point 169.813ºC
Exact Mass 290.26100
PSA 20.23000
LogP 5.81260
Vapour Pressure 0mmHg at 25°C
Index of Refraction 1.472
Precursor  1

DownStream  0