Analytenname

Equilin 3-sulfate-d4 sodium salt

CAS-Nummer

285979-81-9

Molekularformel

C18 2H4 H15 O5 S . Na

Molekulargewicht

374.42

Genaue Masse

374.1102

SMILES

[Na+].[2H]c1cc2[C@H]3CC[C@@]4(C)[C@@H](CC([2H])([2H])C4=O)C3=CCc2c([2H])c1OS(=O)(=O)[O-]

InChI

InChI=1S/C18H20O5S.Na/c1-18-9-8-14-13-5-3-12(23-24(20,21)22)10-11(13)2-4-15(14)16(18)6-7-17(18)19;/h3-5,10,14,16H,2,6-9H2,1H3,(H,20,21,22);/q;+1/p-1/t14-,16+,18+;/m1./s1/i3D,7D2,10D;

IUPAC

sodium;[(9S,13S,14S)-2,4,16,16-tetradeuterio-13-methyl-17-oxo-6,9,11,12,14,15-hexahydrocyclopenta[a]phenanthren-3-yl] sulfate

Nicht gekennzeichnete CAS-Nummer

16680-47-0

SIL-Typ

Deuterium

Lagertemperatur

-20°C

Versandtemperatur

Room Temperature

Herkunftsland

CANADA

Produktformat

Neat

Purity

97 atom % D, min 95% Chemical Purity