Analyte Name

(Lorcaserin-d4) N-beta-D-Glucuronide Sodium Salt

Molecular Formula

C18 D4 H17 Cl N Na O5

Molecular Weight

393.83

Accurate Mass

393.126

SMILES

[2H]C1([2H])Cc2ccc(Cl)cc2[C@@H](C)C([2H])([2H])N1[C@@H]3O[C@H](OC#C[Na])[C@@H](O)[C@H](O)[C@H]3O

InChI

InChI=1S/C18H21ClNO5.Na/c1-3-24-18-16(23)14(21)15(22)17(25-18)20-7-6-11-4-5-12(19)8-13(11)10(2)9-20;/h4-5,8,10,14-18,21-23H,6-7,9H2,2H3;/t10-,14+,15+,16-,17+,18-;/m0./s1/i7D2,9D2;

IUPAC

2-[(2S,3S,4R,5R,6R)-6-[(5R)-7-chloro-2,2,4,4-tetradeuterio-5-methyl-1,5-dihydro-3-benzazepin-3-yl]-3,4,5-trihydroxyoxan-2-yl]oxyethynylsodium

SIL Type

Deuterium

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat