Analytenname

Tauro-beta-muricholic Acid-d4 Sodium Salt

Molekularformel

C26H40D4NNaO7S

Molekulargewicht

541.71

SMILES

[H][C@]1([C@@H](CCC(NC([2H])([2H])C([2H])([2H])S(=O)(O[Na])=O)=O)C)CC[C@@]2([H])[C@]3([H])[C@@H](O)[C@@H](O)[C@]4([H])C[C@@H](CC[C@]4(C)[C@@]3([H])CC[C@@]21C)O

InChI

InChI=1S/C26H45NO7S.Na/c1-15(4-7-21(29)27-12-13-35(32,33)34)17-5-6-18-22-19(9-11-25(17,18)2)26(3)10-8-16(28)14-20(26)23(30)24(22)31;/h15-20,22-24,28,30-31H,4-14H2,1-3H3,(H,27,29)(H,32,33,34);/q;+1/p-1/t15-,16-,17-,18+,19+,20+,22+,23+,24-,25-,26-;/m1./s1/i12D2,13D2;

Nicht gekennzeichnete CAS-Nummer

Free acid: 25696-60-0

SIL-Typ

Deuterium

Lagertemperatur

-20°C

Versandtemperatur

Room Temperature

Herkunftsland

CANADA

Produkttyp

Stable Isotope Labelled

Produktformat

Neat