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Methyl (1S,4aS,8aR)-5-{2-[2-(1-methoxy-3-methyl-1-oxobutan-2-ylaminomethyl)furan-3-yl]-ethyl}-1,4a,6-trimethyl-1,2,3,4,4a,7,8,8a-octahydronaphthalene-1-carboxylate

View entire compound with spectra: 1 NMR, and 1 MS (GC)

Methyl (1S,4aS,8aR)-5-{2-[2-(1-methoxy-3-methyl-1-oxobutan-2-ylaminomethyl)furan-3-yl]-ethyl}-1,4a,6-trimethyl-1,2,3,4,4a,7,8,8a-octahydronaphthalene-1-carboxylate
SpectraBase Compound ID DMbgKTqOw47
InChI InChI=1S/C28H43NO5/c1-18(2)24(25(30)32-6)29-17-22-20(13-16-34-22)10-11-21-19(3)9-12-23-27(21,4)14-8-15-28(23,5)26(31)33-7/h13,16,18,23-24,29H,8-12,14-15,17H2,1-7H3/t23-,24?,27-,28+/m1/s1
InChIKey ZMEQWCYSTAZFPS-UWKPJLDSSA-N
Mol Weight 473.7 g/mol
Molecular Formula C28H43NO5
Exact Mass 473.314123 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IEi9dkhKjsT
Name Methyl (1S,4as,8ar)-5-{2-[2-(1-methoxy-3-methyl-1-oxobutan-2-ylaminomethyl)furan-3-yl]-ethyl}-1,4A,6-trimethyl-1,2,3,4,4A,7,8,8A-octahydronaphthalene-1-carboxylate
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 473.314123484 u
Formula C28H43NO5
InChI InChI=1S/C28H43NO5/c1-18(2)24(25(30)32-6)29-17-22-20(13-16-34-22)10-11-21-19(3)9-12-23-27(21,4)14-8-15-28(23,5)26(31)33-7/h13,16,18,23-24,29H,8-12,14-15,17H2,1-7H3/t23-,24?,27-,28+/m1/s1
InChIKey ZMEQWCYSTAZFPS-UWKPJLDSSA-N
Molecular Weight 473.654 g/mol
SMILES [C@@]12(C(=C(C)CC[C@]2([C@](C(=O)OC)(C)CCC1)[H])CCC1=C(OC=C1)CNC(C(=O)OC)C(C)C)C