(3aR,5S,8aR,9aR)-3-[[[2-(2-furanylmethyl)cyclohexyl]amino]methyl]-5,8a-dimethyl-3,3a,5,6,7,8,9,9a-octahydrobenzo[f]benzofuran-2-one

SpectraBase Compound ID	9sQbdlfOMG5
InChI	InChI=1S/C26H37NO3/c1-17-7-5-11-26(2)15-24-20(14-22(17)26)21(25(28)30-24)16-27-23-10-4-3-8-18(23)13-19-9-6-12-29-19/h6,9,12,14,17-18,20-21,23-24,27H,3-5,7-8,10-11,13,15-16H2,1-2H3/t17-,18?,20+,21?,23?,24+,26+/m0/s1
InChIKey	YEXCLAFCAHCLGV-PGLAXPNQSA-N Google Search
Mol Weight	411.6 g/mol
Molecular Formula	C26H37NO3
Exact Mass	411.277344 g/mol

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SpectraBase Spectrum ID	5JnGXNgLuIH
Name	(3aR,5S,8aR,9aR)-3-[[[2-(2-furanylmethyl)cyclohexyl]amino]methyl]-5,8a-dimethyl-3,3a,5,6,7,8,9,9a-octahydrobenzo[f]benzofuran-2-one
Alternate Name(s)	(3aR,5S,8aR,9aR)-3-[[[2-(2-furfuryl)cyclohexyl]amino]methyl]-5,8a-dimethyl-3,3a,5,6,7,8,9,9a-octahydrobenzo[f]benzofuran-2-one (3aR,5S,8aR,9aR)-3-[[[2-(2-furylmethyl)cyclohexyl]amino]methyl]-5,8a-dimethyl-3,3a,5,6,7,8,9,9a-octahydrobenzo[f]benzofuran-2-one (3aR,5S,8aR,9aR)-3-[[[2-(furan-2-ylmethyl)cyclohexyl]amino]methyl]-5,8a-dimethyl-3,3a,5,6,7,8,9,9a-octahydrobenzo[f][1]benzofuran-2-one
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C26H37NO3
InChI	InChI=1S/C26H37NO3/c1-17-7-5-11-26(2)15-24-20(14-22(17)26)21(25(28)30-24)16-27-23-10-4-3-8-18(23)13-19-9-6-12-29-19/h6,9,12,14,17-18,20-21,23-24,27H,3-5,7-8,10-11,13,15-16H2,1-2H3/t17-,18?,20+,21?,23?,24+,26+/m0/s1
InChIKey	YEXCLAFCAHCLGV-PGLAXPNQSA-N
Molecular Weight	411.586 g/mol
SMILES	N(CC1C(O[C@]2([C@@]1(C=C1[C@](CCC[C@@]1(C2)C)(C)[H])[H])[H])=O)C1C(Cc2occc2)CCCC1
SPLASH	splash10-03di-7921200000-060ddc83ae1a076f5ba5
Wiley ID	1444323