3(S)-Oxidosqualene

Product Specifications

CAS Number

54910-48-4

Synonyms

[S-(all-E)]-2,2-Dimethyl-3-(3,7,12,16,20-pentamethyl-3,7,11,15,19-heneicosapentaenyl)oxirane; (3S)-2,2-Dimethyl-3-[(3E,7E,11E,15E)-3,7,12,16,20-pentamethyl-3,7,11,15,19-heneicosapentaenyl]oxirane; (3S)-2,3-Epoxysqualene; (3S)-2,3-Oxidosqualene; (3S)-Squalene-2,3-epoxide; (S)-2,3-Oxidosqualene; (S)-Squalene 2,3-epoxide; 2,3(S)-Oxidosqualene; Squalene 2,3(S)-oxide

Hazard Statement

Harmful if swallowed

Smiles

COC(=O)CCC[C@H](C)[C@@H]1CC[C@@H]2\C(=C\C=C/3\C[C@@H](CCC3=C)O[Si](C)(C)C(C)(C)C)\CCC[C@]12C

Molecular Formula

C32 H54 O3 Si

Molecular Weight

514.8549

InChI

InChI=1S/C32H54O3Si/c1-23-15-18-27(35-36(8,9)31(3,4)5)22-26(23)17-16-25-13-11-21-32(6)28(19-20-29(25)32)24(2)12-10-14-30(33)34-7/h16-17,24,27-29H,1,10-15,18-22H2,2-9H3/b25-16+,26-17-/t24-,27+,28-,29+,32+/m0/s1

Additionnal Information

IUPAC name: methyl (5S)-5-[(1S,3aR,4E,7aR)-4-[(2Z)-2-[(5R)-5-[tert-butyl(dimethyl)silyl]oxy-2-methylidenecyclohexylidene]ethylidene]-7a-methyl-2,3,3a,5,6,7-hexahydro-1H-inden-1-yl]hexanoate