Analytenname

Pregnenolone-17alpha,21,21,21-D4 Sulfate Sodium Salt

CAS-Nummer

1485492-21-4

Molekularformel

C21H27D4NaO5S

Molekulargewicht

422.55

Genaue Masse

422.2

SMILES

C[C@@](C1=CC2)(CC[C@H](O[S](=O)(O[Na])=O)C1)[C@]3([H])[C@]2([H])[C@@](CC[C@]4([2H])C(C([2H])([2H])[2H])=O)([H])[C@]4(C)CC3

InChI

InChI=1S/C21H32O5S.Na/c1-13(22)17-6-7-18-16-5-4-14-12-15(26-27(23,24)25)8-10-20(14,2)19(16)9-11-21(17,18)3;/h4,15-19H,5-12H2,1-3H3,(H,23,24,25);/q;+1/p-1/t15-,16-,17+,18-,19-,20-,21+;/m0./s1/i1D3,17D;

IUPAC

sodium (3S,8S,9S,10R,13S,14S,17S)-17-(acetyl-d3)-10,13-dimethyl-2,3,4,7,8,9,10,11,12,13,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-yl-17-d sulfate

Nicht gekennzeichnete CAS-Nummer

1852-38-6

SIL-Typ

Deuterium

Lagertemperatur

+4°C

Versandtemperatur

Room Temperature

Herkunftsland

CANADA

Produktformat

Neat

Purity

98 atom % D, min 98% Chemical Purity