Cholesteryl-2,2,3,4,4,6-d6 Octadecanoate

Product Specifications

CAS Number

2692624-28-3

Synonyms

Cholest-5-en-2,2,3,4,4,6-d6-3-ol, 3-octadecanoate, (3ß)- (ACI)

Hazard Statement

No Data Available

Purity

>95% (HPLC)

Smiles

[2H]C1=C2C([2H])([2H])[C@@]([2H])(OC(=O)CCCCCCCCCCCCCCCCC)C([2H])([2H])C[C@]2(C)[C@H]3CC[C@]4(C)[C@H](CC[C@H]4[C@@H]3C1)[C@H](C)CCCC(C)C

Molecular Formula

C45 H74 D6 O2

Molecular Weight

659.15247

InChI

InChI=1S/C45H80O2/c1-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-25-43(46)47-38-30-32-44(5)37(34-38)26-27-39-41-29-28-40(36(4)24-22-23-35(2)3)45(41,6)33-31-42(39)44/h26,35-36,38-42H,7-25,27-34H2,1-6H3/t36-,38+,39+,40-,41+,42+,44+,45-/m1/s1/i26D,30D2,34D2,38D

Additionnal Information

IUPAC name: [(3S,8S,9S,10R,13R,14S,17R)-2,2,3,4,4,6-hexadeuterio-17-[(1R)-1,5-dimethylhexyl]-10,13-dimethyl-1,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-3-yl] octadecanoate