Analyte Name

Domoic Acid-d3

Molecular Formula

C15 D3 H18 N O6

Molecular Weight

314.349

Accurate Mass

314.156

SMILES

C/C([C@H]1CN[C@H](C(O)=O)[C@H]1CC(O)=O)=C/C=C/[C@@H](C([2H])([2H])[2H])C(O)=O

InChI

InChI=1S/C15H21NO6/c1-8(4-3-5-9(2)14(19)20)11-7-16-13(15(21)22)10(11)6-12(17)18/h3-5,9-11,13,16H,6-7H2,1-2H3,(H,17,18)(H,19,20)(H,21,22)/b5-3+,8-4-/t9-,10+,11-,13+/m1/s1/i2D3

IUPAC

(2S,3S,4S)-4-((R,2Z,4E)-6-carboxyhepta-2,4-dien-2-yl-7,7,7-d3)-3-(carboxymethyl)pyrrolidine-2-Carboxylic Acid

Unlabelled CAS Number

14277-97-5

SIL Type

Deuterium

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat