LBF20207TX03: Difference between revisions

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|NMR Spectra=METHYL ESTER ; <SUP><FONT SIZE=-1>1</FONT></SUP>H-NMR(CDCl<SUB><FONT SIZE=-1>3</FONT></SUB>) : <FONT FACE="Symbol">d</FONT> 5.86-5.78(m, 2H), 5.56-5.32(m, 2H), 5.13-4.72(m, 1H), 5.23-4.05(m, 2H), 3.67(S, 3H, OCH<SUB><FONT SIZE=-1>3</FONT></SUB>)[[Reference:Nelson_NA:Jackson_RW:Sebek_OK:,Prostaglandins,1978,16,85|{{RelationTable/GetFirstAuthor|Reference:Nelson_NA:Jackson_RW:Sebek_OK:,Prostaglandins,1978,16,85}}]]
|NMR Spectra=METHYL ESTER ; <SUP><FONT SIZE=-1>1</FONT></SUP>H-NMR(CDCl<SUB><FONT SIZE=-1>3</FONT></SUB>) : <FONT FACE="Symbol">d</FONT> 5.86-5.78(m, 2H), 5.56-5.32(m, 2H), 5.13-4.72(m, 1H), 5.23-4.05(m, 2H), 3.67(S, 3H, OCH<SUB><FONT SIZE=-1>3</FONT></SUB>)[[Reference:Nelson_NA:Jackson_RW:Sebek_OK:,Prostaglandins,1978,16,85|{{RelationTable/GetFirstAuthor|Reference:Nelson_NA:Jackson_RW:Sebek_OK:,Prostaglandins,1978,16,85}}]]
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Revision as of 13:00, 26 July 2009


Upper classes: LB LBF


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Fatty acid
(脂肪酸)
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(グリセロ脂質)
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11-DEHYDROTHROMBOXANE B2
LBF20207TX03.png
Structural Information
7- [ Tetrahydro-4 (S) -hydroxy-2 (R) - (3 (S) -hydroxy-1 (E) -octenyl) -6-oxo-2H-pyran-3 (S) -yl ] -5 (Z) -heptenoic acid
  • 11-DEHYDROTHROMBOXANE B2
  • 7- [ Tetrahydro-4 (S) -hydroxy-2 (R) - (3 (S) -hydroxy-1 (E) -octenyl) -6-oxo-2H-pyran-3 (S) -yl ] -5 (Z) -heptenoic acid
Formula C20H32O6
Exact Mass 368.219888756
Average Mass 368.46448
SMILES C(CC[C@@H](O)C=C[C@@H](O1)[C@H]([C@H](CC1=O)O)CC=CCCCC(O)=O)CC
Physicochemical Information
METHANOL, ETHYL ACETATE Roberts_LJ et al.
Spectral Information
Mass Spectra METHYL ESTER BIS-TMS ETHER ; m/e 526(M+), 511, 455, 370, 295 Nelson_NA et al.
UV Spectra
IR Spectra METHYL ESTER ; CHLOROFORM solution, n 1730 cm-1 Nelson_NA et al.
NMR Spectra METHYL ESTER ; 1H-NMR(CDCl3) : d 5.86-5.78(m, 2H), 5.56-5.32(m, 2H), 5.13-4.72(m, 1H), 5.23-4.05(m, 2H), 3.67(S, 3H, OCH3) Nelson_NA et al.
Other Spectra
Chromatograms
Reported Metabolites, References
Biospecies ID Compound Name Reference Comment
n.a. LBF20207TX03 See above. Nelson_NA et al. 1978
n.a. LBF20207TX03 See above. Roberts_LJ et al. 1978
n.a. LBF20207TX03 See above. Westlund_P et al. 1994
n.a. LBF20207TX03 See above. Westlund_P et al. 1986
n.a. LBF20207TX03 See above. Westlund_P et al. 1986