De-A,B-(24R)-24-[(Methoxymethyl)oxy]cholest-8-en-8-yl triflroromathanesulfonate

SpectraBase Compound ID	CexfkqIwrLJ
InChI	InChI=1S/C21H35F3O5S/c1-14(2)18(28-13-27-5)11-8-15(3)16-9-10-17-19(7-6-12-20(16,17)4)29-30(25,26)21(22,23)24/h7,14-18H,6,8-13H2,1-5H3/t15-,16-,17+,18-,20-/m1/s1
InChIKey	SOGVNRMMMYRACC-BFMVXSJESA-N Google Search
Mol Weight	456.6 g/mol
Molecular Formula	C21H35F3O5S
Exact Mass	456.21573 g/mol

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SpectraBase Spectrum ID	7KWXLPIetPR
Name	De-A,B-(24R)-24-[(Methoxymethyl)oxy]cholest-8-en-8-yl triflroromathanesulfonate
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C21H35F3O5S
InChI	InChI=1S/C21H35F3O5S/c1-14(2)18(28-13-27-5)11-8-15(3)16-9-10-17-19(7-6-12-20(16,17)4)29-30(25,26)21(22,23)24/h7,14-18H,6,8-13H2,1-5H3/t15-,16-,17+,18-,20-/m1/s1
InChIKey	SOGVNRMMMYRACC-BFMVXSJESA-N
Molecular Weight	456.561 g/mol
SMILES	C(S(OC=1[C@]2([C@]([C@@]([C@@](CC[C@](C(C)C)(OCOC)[H])(C)[H])(CC2)[H])(C)CCC1)[H])(=O)=O)(F)(F)F
SPLASH	splash10-03dj-0092000000-5301a193aeff80071204
Source of Spectrum	F-53-4710-7
Synonyms	De-A,B-(24R)-24-[(Methoxymethyl)oxy]cholest-8-en-8-yl triflruromethanesulfonate Trifluoromethanesulfonic acid [(1R,3aR,7aR)-1-[(2R,5R)-5-(methoxymethoxy)-6-methylheptan-2-yl]-7a-methyl-1,2,3,3a,6,7-hexahydroinden-4-yl] ester [(1R,3aR,7aR)-1-[(2R,5R)-5-(methoxymethoxy)-6-methylheptan-2-yl]-7a-methyl-1,2,3,3a,6,7-hexahydroinden-4-yl] trifluoromethanesulfonate [(1R,3aR,7aR)-1-[(1R,4R)-4-(methoxymethoxy)-1,5-dimethyl-hexyl]-7a-methyl-1,2,3,3a,6,7-hexahydroinden-4-yl] trifluoromethanesulfonate [(1R,3aR,7aR)-1-[(2R,5R)-5-(methoxymethoxy)-6-methyl-heptan-2-yl]-7a-methyl-1,2,3,3a,6,7-hexahydroinden-4-yl] tris(fluoranyl)methanesulfonate
Wiley ID	801412