LBF20307PG38: Difference between revisions

Revision as of 15:03, 12 May 2010

Upper classes: LB LBF

Prostaglandin J₂

Structural Information
	7- [ 2 (R) - (3 (S) -Hydroxy-1 (E) -octenyl) -3-oxo-4-cyclopenten-1 (R) -yl ] -5 (Z) -heptenoic acid
	Prostaglandin J₂
	PGJ2
Formula	C20H30O4
Exact Mass	334.21440944799997
Average Mass	334.4498
SMILES	`C(CC[C@@H](O)C=C[C@@H](C(=O)1)[C@@H](CC=CCCCC(O)=O)C=C1)CC`
Physicochemical Information





	ACETONITRILE Mubarik-Ali_Set al. , CHLOROFORM, ETHANOL Bundy_GL et al.

	Bundy_GL et al.
	In aqueous solution prostaglandin D2 undergoes non-enzymatic dehydration and is converted to prostaglandin J2 Fukushima_M .
	The anti-tumor and anti-viral activities of prostaglandin J2 are attributed to Delta 12-prostaglandin J2 which is a degradation product of prostagladnin J2 and is characteristic of its alkylidene cyclopentenone structure Fukushima_M .


Spectral Information
Mass Spectra	TMS ETHER ; M⁺ 478.2934 Bundy_GL et al.
UV Spectra	λ MeOH max = 305( ε 1200), 216( ε 9900)nm Bundy_GL et al.
IR Spectra	ν 3400, 3200, 2660, 1710, 1085, 970 cm^-1 Bundy_GL et al.
NMR Spectra	¹H-NMR(CDCl₃) : δ 7.75-7.55(m, 1H, 9-CH), 6.30-6.10(m, 1H, 10-CH), 5.90(brs, 2H, OH), 5.75-5.35(m, 4H), 4.30-3.95(m, 1H, 15-CH) Bundy_GL et al.
Other Spectra
Chromatograms

Reported Metabolites, References

Biospecies	ID	Compound Name	Reference
n.a.	LBF20307PG38	See above.	Bundy_GL et al. 1983
n.a.	LBF20307PG38	See above.	Fukushima_M 1992
n.a.	LBF20307PG38	See above.	Mubarik-Ali_S et al. 1980

@@ Line 8: / Line 8: @@
 |SysName=7- [ 2 (R) - (3 (S) -Hydroxy-1 (E) -octenyl) -3-oxo-4-cyclopenten-1 (R) -yl ] -5 (Z) -heptenoic acid
 |Common Name=&&Prostaglandin J_2&&
-|Solubility=ACETONITRILE<!--1048-->
+|Solubility=ACETONITRILE<!--以下1048-->[[Reference:Reference:Mubarik-Ali_S:Chapeleo_CB:Finch_MAW:Roberts_SM:Woolley_GT:Cave_RJ:and Newton_RF:,J. Chem. Soc.,1980,,2093|
-[[Reference:Reference:Mubarik-Ali_S:Chapeleo_CB:Finch_MAW:Roberts_SM:Woolley_GT:Cave_RJ:and Newton_RF:,J. Chem. Soc.,1980,,2093|
 {{RelationTable/GetFirstAuthor|Reference:Mubarik-Ali_S:Chapeleo_CB:Finch_MAW:Roberts_SM:Woolley_GT:Cave_RJ:and Newton_RF:,J. Chem. Soc.,1980,,2093}}]]
 , CHLOROFORM, ETHANOL [[Reference:Bundy_GL:Morton_DR:Peterson_DC:Nishizawa_EE:Miller_WL:,J. Med. Chem.,1983,26,790|{{RelationTable/GetFirstAuthor|Reference:Bundy_GL:Morton_DR:Peterson_DC:Nishizawa_EE:Miller_WL:,J. Med. Chem.,1983,26,790}}]]