Oenin-d6 Chloride

Nazwa analitu

Oenin-d6 Chloride

Wzór cząsteczkowy

C23 D6 H19 O12 . Cl

Masa cząsteczkowa

534.927

Dokładna masa

534.141

SMILES

[Cl-].[2H]C([2H])([2H])Oc1cc(cc(OC([2H])([2H])[2H])c1O)c2[o+]c3cc(O)cc(O)c3cc2O[C@H]4O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]4O

InChI

InChI=1S/C23H24O12.ClH/c1-31-14-3-9(4-15(32-2)18(14)27)22-16(7-11-12(26)5-10(25)6-13(11)33-22)34-23-21(30)20(29)19(28)17(8-24)35-23;/h3-7,17,19-21,23-24,28-30H,8H2,1-2H3,(H2-,25,26,27);1H/t17-,19-,20+,21-,23-;/m0./s1/i1D3,2D3;

IUPAC

(2R,3S,4R,5R,6S)-2-[5,7-dihydroxy-2-[4-hydroxy-3,5-bis(trideuteriomethoxy)phenyl]chromenylium-3-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol;chloride

Typ SIL

Deuterium

Temperatura podczas transportu

Room Temperature

Kraj pochodzenia

CANADA

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