echimidine

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IUPAC Name :[(7R,8R)-7-[(Z)-2-methylbut-2-enoyl]oxy-5,6,7,8-tetrahydro-3H-pyrrolizin-1-yl]methyl (2R)-2,3-dihydroxy-2-[(1S)-1-hydroxyethyl]-3-methylbutanoate
InChI :InChI=1/C20H31NO7/c1-6-12(2)17(23)28-15-8-10-21-9-7-14(16(15)21)11-27-18(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-/m0/s1
Std.InChI: InChI=1S/C20H31NO7/c1-6-12(2)17(23)28-15-8-10-21-9-7-14(16(15)21)11-27-18(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-/m0/s1
InChIKey :HRSGCYGUWHGOPY-LYHHMGRNBR
Std.InChIKey: HRSGCYGUWHGOPY-LYHHMGRNSA-N
SMILES :C/C=C(/C)\C(=O)O[C@@H]1CCN2[C@@H]1C(=CC2)COC(=O)[C@@]([C@H](C)O)(C(C)(C)O)O
Molar Refractivity :102.08 ± 0.4 cm3 (est)
Parachor :854.7 ± 6.0 cm3 (est)
Index of Refraction :1.565 ± 0.03 (est)
Surface Tension :55.3 ± 5.0 dyne/cm (est)
Density :1.26 ± 0.1 g/cm3 (est)
Polarizability :40.46 ± 0.5 10-24cm3 (est)