Nombre del analito

Apigenin-d5 7-Glucuronide

Fórmula molecular

C21H13D5O11

Peso molecular

451.39

Masa exacta

451.22

SMILES

OC1=C(C(C([2H])=C(C2=CC([2H])=C(O)C([2H])=C2)O3)=O)C3=C([2H])C(O[C@@H]4O[C@H](C(O)=O)[C@@H](O)[C@H](O)[C@H]4O)=C1[2H]

InChI

InChI=1S/C21H18O11/c22-9-3-1-8(2-4-9)13-7-12(24)15-11(23)5-10(6-14(15)31-13)30-21-18(27)16(25)17(26)19(32-21)20(28)29/h1-7,16-19,21-23,25-27H,(H,28,29)/t16-,17-,18+,19-,21+/m0/s1/i3D,4D,5D,6D,7D

IUPAC

(2S,3S,4S,5R,6S)-3,4,5-trihydroxy-6-((5-hydroxy-2-(4-hydroxyphenyl-3,5-d2)-4-oxo-4H-chromen-7-yl-3,6,8-d3)oxy)tetrahydro-2H-pyran-2-carboxylic acid

Número CAS sin etiquetar

29741-09-1

Tipo SIL

Deuterium

Temperatura de envío

Room Temperature

País de origen

CANADA

Tipo de producto

Stable Isotope Labelled

Formato del producto

Neat