(2R)-1-[(Hydroxy{[(1S,2R,3R,4S,5S,6R)-2,3,4,5,6-Pentahydroxycyclohexyl]Oxy}Phosphoryl)Oxy]-3-(Stearoyloxy)-2-Propanyl (9Z)-9-Octadecenoate

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Properties Simple | Detailed

Formula C45H85O13P
IUPAC Name [(2r)-3-[hydroxy-[(2r,3s,5r,6r)-2,3,4,5,6-pentahydroxycyclohexoxy]phosphoryl]oxy-2-[(z)-octadec-9-enoyl]oxy-propyl] octadecanoate
Molecular Mass 865.122 g·mol−1
Heat of Formation -3283.9 ± 16.7 kJ·mol−1
Dipole Moment 5.68 ± 1.08 D
Volume 1147.45 Å 3
Surface Area 1004.16 Å 2
HOMO Energy -9.64 ± 0.55 eV
LUMO Energy -0.32 ± eV
Point Group Symmetry C1
InChIKey YOBFISPJJWPPTK-BAAZTTAESA-N
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