LBF20207PG01

LipidBank Top (トップ)

Fatty acid (脂肪酸)

Glycerolipid (グリセロ脂質)

Sphingolipid (スフィンゴ脂質)

Journals (雑誌一覧)

How to edit (ページの書き方)

Upper classes: LB LBF

IDs and Links
LipidBank	XPR1000
LipidMaps	LMFA03010005
CAS
KEGG	{{{KEGG}}}
KNApSAcK	{{{KNApSAcK}}}
mol	LBF20207PG01

Prostaglandin A1
Structural Information
Systematic Name	7- [2R- (3S -Hydroxy-trans-1-octenyl) -5-oxo-3-cyclopenten-1R -yl] heptanoic acid
Common Name	Prostaglandin A1 (8R,12S,13E,15S) -15-Hydroxy-9-oxo-10,13-prostadienoic acid 7- [ 2 (R) - (3 (S) -Hydroxy-1 (E) -octenyl) -5-oxo-3-cyclopenten-1 (R) -yl ] heptanoic acid
Symbol	PGA1
Formula	C20H32O4
Exact Mass	336.23005951199997
Average Mass	336.46567999999996
SMILES	C(CC[C@@H](O)C=C[C@H]([C@H]1CCCCCCC(O)=O)C=CC(=O)1)CC
Physicochemical Information
Melting Point	42-44°C Pike_JE et al.
Boiling Point
Density
Optical Rotation	ORD (H2O, C=0.0040g/ml) : 256(+35.000°), 220(-43.000°) Andersen_NH
Refractive Index
Solubility	ETHANOL, CHLOROFORM Pike_JE et al., METHANOL Andersen_NH
Source	Prostaglandin A1 is found in human seminal plasma Bergstrom_S .
Chemical Synthesis	Pike_JE et al.
Metabolism
Biological Activity	Prostaglandin A1 relaxes uterine muscle and shows hypotensive effects on rat and dog Bergstrom_S et al..
Genetic Information
Note
Spectral Information
Mass Spectra	m/e, 336(M+), 318(M-18), 300(M-36), 265(M-71), 247, 219, 190 Pike_JE et al.
UV Spectra	λ EtOH max     = 217nm( ε 11,650) Pike_JE et al.
IR Spectra	NUJOL : ν 3420, 2740, 2700, 2660, 2600, 1715, 1700, 1585, 1275, 1200,1180, 1020, 720cm-1 Pike_JE et al.
NMR Spectra	1H-NMR(CDCl3, TMS) : δ , 7.52(dd, 1H), 6.17(dd, 1H), 5.6(m, 2H), 4.1(m, 1H, 15-CH), 3.25(12H) Pike_JE et al.
Other Spectra	ORD(H2O, C=0.0040g/100ml), 256(+35, 000°), 220(-43,000°) Andersen_NH
Chromatograms

Reported Metabolites, References
Biospecies ID Compound Name Reference Comment n.a. LBF20207PG01 See above. Andersen_NH 1969 n.a. LBF20207PG01 See above. Bergstrom_S 1967 n.a. LBF20207PG01 See above. Bergstrom_S et al. 1968 n.a. LBF20207PG01 See above. Pike_JE et al. 1969