(2S)-2-[(1S,3aS,4S,7aS)-4-Benzenesulfony-7a-methyl-octahydroinden-1-yl]-6-methylheptanoic acid ethyl ester

SpectraBase Compound ID	BJi1iu7GOi
InChI	InChI=1S/C26H40O4S/c1-5-30-25(27)21(14-9-11-19(2)3)22-16-17-23-24(15-10-18-26(22,23)4)31(28,29)20-12-7-6-8-13-20/h6-8,12-13,19,21-24H,5,9-11,14-18H2,1-4H3/t21-,22-,23+,24-,26-/m0/s1
InChIKey	HDJSIVKATVIBGQ-AMWBNRJOSA-N Google Search
Mol Weight	448.7 g/mol
Molecular Formula	C26H40O4S
Exact Mass	448.264731 g/mol

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SpectraBase Spectrum ID	CqXESGHuCNP
Name	(2S)-2-[(1S,3aS,4S,7aS)-4-Benzenesulfony-7a-methyl-octahydroinden-1-yl]-6-methylheptanoic acid ethyl ester
Copyright	Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C26H40O4S
InChI	InChI=1S/C26H40O4S/c1-5-30-25(27)21(14-9-11-19(2)3)22-16-17-23-24(15-10-18-26(22,23)4)31(28,29)20-12-7-6-8-13-20/h6-8,12-13,19,21-24H,5,9-11,14-18H2,1-4H3/t21-,22-,23+,24-,26-/m0/s1
InChIKey	HDJSIVKATVIBGQ-AMWBNRJOSA-N
Molecular Weight	448.662 g/mol
SMILES	[C@]1(S(=O)(=O)c2ccccc2)([C@@]2([C@@]([C@@]([C@@](C(=O)OCC)(CCCC(C)C)[H])([H])CC2)(C)CCC1)[H])[H]
SPLASH	splash10-0019-3932000000-9ab23c6623c9f0fe69a8
Source of Spectrum	QC-10-1596-10a
Wiley ID	871357