LBF16401SC02

Upper classes: LB LBF

IDs and Links
LipidBank	DFA0205
LipidMaps	LMFA01030166
CAS
KEGG	{{{KEGG}}}
KNApSAcK	{{{KNApSAcK}}}
mol	LBF16401SC02

GlcNAca/b1-3Xyla-4Galb1-3GalNAca1-4(NeuAc?1-2NeuGc4Mea1-3)GalNAcb1-4(EtnP-6)GlcNAcb1-3Manb1-4Glcb1-1Cer
Structural Information
Systematic Name	6, 9, 12, 15-Hexadesatetraenoic acid
Common Name
Symbol
Formula	C16H24O2
Exact Mass	248.17763001199998
Average Mass	248.36056
SMILES	C=CCC=CCC=CCC=CCCCCC(O)=O
Physicochemical Information
Melting Point
Boiling Point
Density
Optical Rotation	1.4870 at 29°C
Refractive Index
Solubility	soluble in acetone, alcohol, ether, carbon disuifide and petroleum ether.
Source
Chemical Synthesis
Metabolism
Biological Activity
Genetic Information
Note
Spectral Information
Mass Spectra	""HR-EI-MS(METHYL ESTER): M/Z; 262.19326(M) EI-MS(PYRROLIDIDE): M/Z; 154,166,194,206,260(M-41), 272(M=29), 286(M-15)EI-MS(PICOLINYL ESTER): M/Z; 339(M), 338(M-1), 324(M-15), 298(M-41), 272, 258, 232, 218, 192 "" HayashiAet al.
UV Spectra
IR Spectra
NMR Spectra	""CMR(METHYL ESTER): C12, 127.093; C13, 128.939; C14, 31.529; C15, 136.736 C16: 114.741ppm PMR(METHYL ESTER): CH2=CH-C(TERMINAL OLEFINIC PROTON), 4.92-4.96, 5.62-5.88ppm(MULTIPLETS)."" HayashiAet al.
Other Spectra
Chromatograms

Reported Metabolites, References
Biospecies ID Compound Name Reference Comment n.a. LBF16401SC02 See above. Hayashi_A et al. 1970 n.a. LBF16401SC02 See above. Hayashi_A et al. 1971