Analytenname

Dehydrocholic Acid-13C3

Molekularformel

13C3 C21 H34 O5

Molekulargewicht

405.5

Genaue Masse

405.25

SMILES

C[C@H]([13CH2][13CH2][13C](=O)O)[C@H]1CC[C@H]2[C@H]3[C@H](CC(=O)[C@]12C)[C@@]4(C)CCC(=O)C[C@H]4CC3=O

InChI

InChI=1S/C24H34O5/c1-13(4-7-21(28)29)16-5-6-17-22-18(12-20(27)24(16,17)3)23(2)9-8-15(25)10-14(23)11-19(22)26/h13-14,16-18,22H,4-12H2,1-3H3,(H,28,29)/t13-,14+,16-,17+,18+,22+,23+,24-/m1/s1/i4+1,7+1,21+1

IUPAC

(4R)-4-[(5S,8R,9S,10S,13R,14S,17R)-10,13-dimethyl-3,7,12-trioxo-1,2,4,5,6,8,9,11,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-17-yl](1,2,3-13C_3)pentanoic acid

Nicht gekennzeichnete CAS-Nummer

81-23-2

SIL-Typ

Carbon

Versandtemperatur

Room Temperature

Herkunftsland

CANADA

Produkttyp

Stable Isotope Labelled

Produktformat

Neat