Analyte Name

(+)-Echimidine-D6 Hydrochloride Salt

Molecular Formula

C20 H25 D6 N O7 . HCl

Molecular Weight

439.96055

Accurate Mass

439.2244

SMILES

Cl.[2H]C([2H])([2H])C(O)(C([2H])([2H])[2H])[C@](O)([C@H](C)O)C(=O)OCC1=CCN2CC[C@@H](OC(=O)\C(=C/C)\C)[C@@H]12

InChI

InChI=1S/C20H31NO7.ClH/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;1H/b12-6-;/t13-,15+,16+,20-;/m0./s1/i4D3,5D3;

IUPAC

[(7R,8R)-7-[(Z)-2-methylbut-2-enoyl]oxy-5,6,7,8-tetrahydro-3H-pyrrolizin-1-yl]methyl (2R)-4,4,4-trideuterio-2,3-dihydroxy-2-[(1S)-1-hydroxyethyl]-3-(trideuteriomethyl)butanoate;hydrochloride

SIL Type

Deuterium

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat