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Cholesterol n-hexyl carbonate(15455-80-8) IR2
Product NameCholesterol n-hexyl carbonate
CAS15455-80-8
Molecular FormulaC34H58O3
Molecular Weight514.82
InChIInChI=1/C34H58O3/c1-7-8-9-10-22-36-32(35)37-27-18-20-33(5)26(23-27)14-15-28-30-17-16-29(25(4)13-11-12-24(2)3)34(30,6)21-19-31(28)33/h14,24-25,27-31H,7-13,15-23H2,1-6H3/t25-,27+,28+,29-,30+,31+,33+,34-/s3
InChIKey FKPRFOWGXDAFNL-IOFXJBFFNA-N
Smiles[C@@]12([H])CC=C3C[C@@H](OC(=O)OCCCCCC)CC[C@]3(C)[C@@]1([H])CC[C@]1(C)[C@H](CC[C@@]21[H])[C@H](C)CCCC(C)C |&1:0,6,19,21,25,27,30,32,r|
