echimidine N-oxide

Right Click Jmol Molecule For More Options. Jmol is a free download found Here.
IUPAC Name :[(7R,8R)-7-[(Z)-2-methylbut-2-enoyl]oxy-4-oxido-5,6,7,8-tetrahydro-3H-pyrrolizin-4-ium-1-yl]methyl 2,3-dihydroxy-2-(1-hydroxyethyl)-3-methylbutanoate
InChI :InChI=1/C20H31NO8/c1-6-12(2)17(23)29-15-8-10-21(27)9-7-14(16(15)21)11-28-18(24)20(26,13(3)22)19(4,5)25/h6-7,13,15-16,22,25-26H,8-11H2,1-5H3/b12-6-/t13?,15-,16-,20?,21?/m1/s1
Std.InChI: InChI=1S/C20H31NO8/c1-6-12(2)17(23)29-15-8-10-21(27)9-7-14(16(15)21)11-28-18(24)20(26,13(3)22)19(4,5)25/h6-7,13,15-16,22,25-26H,8-11H2,1-5H3/b12-6-/t13?,15-,16-,20?,21?/m1/s1
InChIKey :KDJGEXAPDZNXSD-VSXSYYALBI
Std.InChIKey: KDJGEXAPDZNXSD-VSXSYYALSA-N
SMILES :C/C=C(/C)\C(=O)O[C@@H]1CC[N+]2([C@@H]1C(=CC2)COC(=O)C(C(C)O)(C(C)(C)O)O)[O-]