Analyte Name

Cholesteryl N-(trimethylammonioethyl)carbamate chloride

CAS Number

188022-80-2

Molecular Formula

C33 H59 N2 O2 . Cl

Molecular Weight

551.287

Accurate Mass

550.427

SMILES

[Cl-].CC(C)CCC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4CC(CC[C@]4(C)[C@H]3CC[C@]12C)OC(=O)NCC[N+](C)(C)C

InChI

InChI=1S/C33H58N2O2.ClH/c1-23(2)10-9-11-24(3)28-14-15-29-27-13-12-25-22-26(37-31(36)34-20-21-35(6,7)8)16-18-32(25,4)30(27)17-19-33(28,29)5;/h12,23-24,26-30H,9-11,13-22H2,1-8H3;1H/t24-,26?,27+,28-,29+,30+,32+,33-;/m1./s1

IUPAC

2-[[(8S,9S,10R,13R,14S,17R)-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl]oxycarbonylamino]ethyl-trimethylazanium;chloride

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat