Cholestano[3,2-c]isoxazole

SpectraBase Compound ID	E1DfcB7Rp1L
InChI	InChI=1S/C27H45NO/c1-17(2)7-6-8-18(3)21-11-12-22-20-10-9-19-15-25-24(16-29-28-25)27(19,5)23(20)13-14-26(21,22)4/h17-24H,6-16H2,1-5H3/t18-,19?,20+,21-,22+,23+,24?,26-,27+/m1/s1
InChIKey	LABDWIXEOKOAKJ-UPAZCWHKSA-N Google Search
Mol Weight	399.7 g/mol
Molecular Formula	C27H45NO
Exact Mass	399.350115 g/mol

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SpectraBase Spectrum ID	EsilbLHBabU
Name	Cholestano[3,2-c]isoxazole
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C27H45NO
InChI	InChI=1S/C27H45NO/c1-17(2)7-6-8-18(3)21-11-12-22-20-10-9-19-15-25-24(16-29-28-25)27(19,5)23(20)13-14-26(21,22)4/h17-24H,6-16H2,1-5H3/t18-,19?,20+,21-,22+,23+,24?,26-,27+/m1/s1
InChIKey	LABDWIXEOKOAKJ-UPAZCWHKSA-N
Molecular Weight	399.663 g/mol
SMILES	[C@@]12([C@@]3([C@@]([C@@]4(CC[C@@]([C@]4(CC3)C)([C@@](CCCC(C)C)(C)[H])[H])[H])([H])CCC2CC=2C1CON2)[H])C
SPLASH	splash10-0h2k-0509100000-75d1173915a43177a0bd
Source of Spectrum	KC-1992-431-14
Synonyms	(1R,3aS,3bS,9bS,9cS,11aR)-1-[(1R)-1,5-dimethylhexyl]-9b,11a-dimethyl-1,2,3,3a,3b,4,5,5a,6,9,9a,9b,9c,10,11,11a-hexadecahydroindeno[4',5':6,7]indeno[2,1-c]isoxazole
Wiley ID	776133