Analyte Name

(E)-4-Hydroxy Toremifene-d6

CAS Number

1795153-59-1

Molecular Formula

C28 H38 O19

Molecular Weight

678.59

Accurate Mass

678.201

SMILES

CC(=O)OCC1O[C@@H](OCC2O[C@@H](OC(=O)C)C(OC(=O)C)C(OC(=O)C)[C@H]2OC(=O)C)C(OC(=O)C)C(OC(=O)C)[C@H]1OC(=O)C

InChI

InChI=1S/C28H38O19/c1-11(29)37-9-19-21(39-12(2)30)23(41-14(4)32)25(43-16(6)34)27(46-19)38-10-20-22(40-13(3)31)24(42-15(5)33)26(44-17(7)35)28(47-20)45-18(8)36/h19-28H,9-10H2,1-8H3/t19?,20?,21-,22-,23?,24?,25?,26?,27+,28+/m0/s1

IUPAC

[(3S,6R)-3,4,5-triacetyloxy-6-[[(3S,6S)-3,4,5,6-tetraacetyloxyoxan-2-yl]methoxy]oxan-2-yl]methyl acetate

Unlabelled CAS Number

177748-22-0

SIL Type

Deuterium

Storage Temperature

-20°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Type

Stable Isotope Labelled

Product Format

Neat