Product Code

TRC-S465857

Product Format

Neat

Molecular Formula

C25H19D3O10

Molecular Weight

485.46

Product Categories

TRC, Stable isotopes

Product Type

Stable Isotope Labelled

Unlabelled CAS Number

22888-70-6

Price and availability

48-hour USA dispatch time

Freight restricted.

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Product Information

Chemical Data

Analyte Name

Silybin A-d3

Molecular Formula

C25H19D3O10

Molecular Weight

485.46

Accurate Mass

485.14

SMILES

OC[C@H]1OC2=C(C=C([C@H]3OC(C=C(O)C=C4O)=C4C([C@@H]3O)=O)C=C2)O[C@@H]1C5=CC=C(O)C(OC([2H])([2H])[2H])=C5

InChI

InChI=1S/C25H22O10/c1-32-17-6-11(2-4-14(17)28)24-20(10-26)33-16-5-3-12(7-18(16)34-24)25-23(31)22(30)21-15(29)8-13(27)9-19(21)35-25/h2-9,20,23-29,31H,10H2,1H3/t20-,23+,24-,25-/m1/s1/i1D3

IUPAC

(2R,3R)-3,5,7-trihydroxy-2-((2R,3R)-3-(4-hydroxy-3-(methoxy-d3)phenyl)-2-(hydroxymethyl)-2,3-dihydrobenzo[b][1,4]dioxin-6-yl)chroman-4-one

Unlabelled CAS Number

22888-70-6

SIL Type

Deuterium

Product Data

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat

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Silybin A-d3

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