LBG00kkk:R:R:16402BC01

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LipidBank	EEL0208
LipidMaps	[1]
CAS
KEGG	{{{KEGG}}}
KNApSAcK	{{{KNApSAcK}}}
mol	LBG00kkk:R:R:16402BC01

(S) -1,2-O-Isopropylidene-3-O-geranylgeranylglycerol
Structural Information
Systematic Name	(S) -1,2-O-Isopropylidene-3-O-geranylgeranylglycerol
Common Name	(S) -1,2-O-Isopropylidene-3-O-geranylgeranylglycerol
Symbol
Formula	C29H56O3
Exact Mass	452.422945658
Average Mass	452.75314
SMILES	O(C(C)(C)O)CC([H])C
Physicochemical Information
Melting Point
Boiling Point
Density
Optical Rotation
Refractive Index
Solubility
Source
Chemical Synthesis
Metabolism
Biological Activity
Genetic Information
Note
Spectral Information
Mass Spectra	(EI 70eV)69(100), 93(22), 121(10.6), 135(15.9), 161(5.7), 175(2.9), 189(1.9), 203(2.9), 225(2.4), 272(3.9), 389(M-CH3, 2.1), 404(M+, 0.7)<<0174>>,
UV Spectra
IR Spectra
NMR Spectra	1H NMR (300MHz,CDCl3)1.33(3H, s, CH3), 1.42(3H, s, CH3), 1.55-1.65(15H, m, 5CH3 on geranylgeranyl), 1.9-2.1(12H, br m, 6CH2 on geranylgeranyl), 3.38-3.68(3H, br m), 4.0-4.1(3H, m), 4.23-4.3(1H, m), 5.08[3H, br m, H at C(6), C(10) and C(14) on geranylgeranyl], 5.3[1H, t, J=6.8Hz H at C(2) on geranylgeranyl] 13C NMR(75MHz,CDCl3)16.1(q), 16.6(q), 17.8(q), 25.5(q), 25.8(q), 26.4(t), 26.7(t), 26.87(t), 26.93(q), 39.7(t), 39.81(t), 39.87(t), 67.1(t), 68.1(t), 71.1(t), 74.9(d), 109.5(s), 120.7(d), 123.9(d), 124.3(d), 124.5(d), 131.4(s), 135.1(s), 135.4(s), 140.6(s)<<0174>>,
Other Spectra
Chromatograms	silica gel flash chromatography (Rf=0.35, ethyl acetate-hexane(2:23) )<<0174>>,