Estriol-d3

Analyte Name

Estriol-d3

CAS Number

79037-36-8

Molecular Formula

C18 2H3 H21 O3

Molecular Weight

291.40

Accurate Mass

291.1914

SMILES

[2H]c1cc2[C@H]3CC[C@@]4(C)[C@@H](C[C@@H](O)[C@]4([2H])O)[C@@H]3CCc2c([2H])c1O

InChI

InChI=1S/C18H24O3/c1-18-7-6-13-12-5-3-11(19)8-10(12)2-4-14(13)15(18)9-16(20)17(18)21/h3,5,8,13-17,19-21H,2,4,6-7,9H2,1H3/t13-,14-,15+,16-,17+,18+/m1/s1/i3D,8D,17D

IUPAC

(8R,9S,13S,14S,16R,17R)-2,4,17-trideuterio-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthrene-3,16,17-triol

Unlabelled CAS Number

50-27-1

SIL Type

Deuterium

Storage Temperature

+4°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Type

Stable Isotope Labelled; Metabolite; API

Product Format

Neat

API Family

Estriol

Purity

>95% (HPLC)