LBF18207TX01: Difference between revisions
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|LipidMaps=LMFA03030003 | |LipidMaps=LMFA03030003 | ||
|SysName=5- [ Tetrahydro-4 (S) ,6-dihydroxy-2 (R) - (3 (S) -hydroxy-1 (E) -octenyl) -2H-pyran-3 (S) -yl ] -3 (Z) -pentenoic acid | |SysName=5- [ Tetrahydro-4 (S) ,6-dihydroxy-2 (R) - (3 (S) -hydroxy-1 (E) -octenyl) -2H-pyran-3 (S) -yl ] -3 (Z) -pentenoic acid | ||
|Common Name=&&2,3-DINORTHROMBOXANE B2&& | |Common Name=&&2,3-DINORTHROMBOXANE B2&&5- [ Tetrahydro-4 (S) ,6-dihydroxy-2 (R) - (3 (S) -hydroxy-1 (E) -octenyl) -2H-pyran-3 (S) -yl ] -3 (Z) -pentenoic acid&& | ||
|Solubility=ETHYL ACETATE, DIETHYL ETHER, DICHLOROMETHANE [[Reference:Nelson_NA:Jackson_RW:Sebek_OK:,Prostaglandins,1978,16,85|{{RelationTable/GetFirstAuthor|Reference:Nelson_NA:Jackson_RW:Sebek_OK:,Prostaglandins,1978,16,85}}]] | |Solubility=ETHYL ACETATE, DIETHYL ETHER, DICHLOROMETHANE [[Reference:Nelson_NA:Jackson_RW:Sebek_OK:,Prostaglandins,1978,16,85|{{RelationTable/GetFirstAuthor|Reference:Nelson_NA:Jackson_RW:Sebek_OK:,Prostaglandins,1978,16,85}}]] | ||
|Mass Spectra=METHYL ESTER TRIS-TMS ETHER ; m/e 557, 482, 467, 411, 338, 301, 295, 267, 228, 225, 217 [[Reference:Kindahl_H:,Prostaglandins,1977,13,619|{{RelationTable/GetFirstAuthor|Reference:Kindahl_H:,Prostaglandins,1977,13,619}}]] | |Mass Spectra=METHYL ESTER TRIS-TMS ETHER ; m/e 557, 482, 467, 411, 338, 301, 295, 267, 228, 225, 217 [[Reference:Kindahl_H:,Prostaglandins,1977,13,619|{{RelationTable/GetFirstAuthor|Reference:Kindahl_H:,Prostaglandins,1977,13,619}}]] | ||
|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> 5.77-5.0(m, 6H), 4.50-3.96(m, 5H), 3.71(s, 3H, OCH<SUB><FONT SIZE=-1>3</FONT></SUB>), 3.20-3.00(m, 2H) [[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> 5.77-5.0(m, 6H), 4.50-3.96(m, 5H), 3.71(s, 3H, OCH<SUB><FONT SIZE=-1>3</FONT></SUB>), 3.20-3.00(m, 2H) [[Reference:Nelson_NA:Jackson_RW:Sebek_OK:,Prostaglandins,1978,16,85|{{RelationTable/GetFirstAuthor|Reference:Nelson_NA:Jackson_RW:Sebek_OK:,Prostaglandins,1978,16,85}}]] | ||
}} | }} |
Revision as of 00:01, 20 December 2008
IDs and Links | |
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LipidBank | XPR2111 |
LipidMaps | LMFA03030003 |
CAS | |
KEGG | {{{KEGG}}} |
KNApSAcK | {{{KNApSAcK}}} |
mol | LBF18207TX01 |
2,3-DINORTHROMBOXANE B2 | |
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Structural Information | |
5- [ Tetrahydro-4 (S) ,6-dihydroxy-2 (R) - (3 (S) -hydroxy-1 (E) -octenyl) -2H-pyran-3 (S) -yl ] -3 (Z) -pentenoic acid | |
| |
Formula | C18H30O6 |
Exact Mass | 342.204238692 |
Average Mass | 342.42719999999997 |
SMILES | [C@@H]([C@@H](CC=CCC(O)=O)1)(C=C[C@H](O)CCCCC)OC(O)C[C@@H]1O |
Physicochemical Information | |
ETHYL ACETATE, DIETHYL ETHER, DICHLOROMETHANE Nelson_NA et al. | |
Spectral Information | |
Mass Spectra | METHYL ESTER TRIS-TMS ETHER ; m/e 557, 482, 467, 411, 338, 301, 295, 267, 228, 225, 217 KindahlH |
UV Spectra | |
IR Spectra | |
NMR Spectra | METHYL ESTER ; 1H-NMR(CDCl3) : d 5.77-5.0(m, 6H), 4.50-3.96(m, 5H), 3.71(s, 3H, OCH3), 3.20-3.00(m, 2H) Nelson_NA et al. |
Other Spectra | |
Chromatograms |
Reported Metabolites, References | ||||||||||||||||||||
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