Analyte Name

5'-DMT DU Succinate Potassium Salt

Molecular Formula

C34 H33 K N2 O10

Molecular Weight

668.74

Accurate Mass

668.18

SMILES

COC1=CC=C(C(C2=CC=CC=C2)(OC[C@@H]3[C@@H](OC(CCC([O-])=O)=O)C[C@@H](O3)N4C(NC(C=C4)=O)=O)C5=CC=C(OC)C=C5)C=C1.[K+]

InChI

InChI=1S/C34H34N2O10.K/c1-42-25-12-8-23(9-13-25)34(22-6-4-3-5-7-22,24-10-14-26(43-2)15-11-24)44-21-28-27(46-32(40)17-16-31(38)39)20-30(45-28)36-19-18-29(37)35-33(36)41;/h3-15,18-19,27-28,30H,16-17,20-21H2,1-2H3,(H,38,39)(H,35,37,41);/q;+1/p-1/t27-,28+,30+;/m0./s1

IUPAC

potassium 4-(((2R,3S,5R)-2-((bis(4-methoxyphenyl)(phenyl)methoxy)methyl)-5-(2,4-dioxo-3,4-dihydropyrimidin-1(2H)-yl)tetrahydrofuran-3-yl)oxy)-4-oxobutanoate

Alternate CAS Number

93778-64-4

Country of Origin

CANADA

Product Format

Neat