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N-[[(3aR,5S,6aR)-2-keto-6a-methoxy-3,3a,5,6-tetrahydro-1H-furo[4,5-d]imidazol-5-yl]methyl]-4-bromo-1H-pyrrole-2-carboxamide

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

N-[[(3aR,5S,6aR)-2-keto-6a-methoxy-3,3a,5,6-tetrahydro-1H-furo[4,5-d]imidazol-5-yl]methyl]-4-bromo-1H-pyrrole-2-carboxamide
SpectraBase Compound ID DKBOayL4vVJ
InChI InChI=1S/C12H15BrN4O4/c1-20-12-3-7(21-10(12)16-11(19)17-12)5-15-9(18)8-2-6(13)4-14-8/h2,4,7,10,14H,3,5H2,1H3,(H,15,18)(H2,16,17,19)/t7-,10+,12+/m0/s1
InChIKey WRJYHSZMHSXLMX-HNBZJPLGSA-N
Mol Weight 359.18 g/mol
Molecular Formula C12H15BrN4O4
Exact Mass 358.027668 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4CLxgeSQyjU
Name (+)-Antipode of Slagenin C
Alternate Name(s) N-[[(3aR,5S,6aR)-6a-methoxy-2-oxo-3,3a,5,6-tetrahydro-1H-furo[2,3-d]imidazol-5-yl]methyl]-4-bromo-1H-pyrrole-2-carboxamide N-[[(3aR,5S,6aR)-6a-methoxy-2-oxidanylidene-3,3a,5,6-tetrahydro-1H-furo[2,3-d]imidazol-5-yl]methyl]-4-bromanyl-1H-pyrrole-2-carboxamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H15BrN4O4
InChI InChI=1S/C12H15BrN4O4/c1-20-12-3-7(21-10(12)16-11(19)17-12)5-15-9(18)8-2-6(13)4-14-8/h2,4,7,10,14H,3,5H2,1H3,(H,15,18)(H2,16,17,19)/t7-,10+,12+/m0/s1
InChIKey WRJYHSZMHSXLMX-HNBZJPLGSA-N
Molecular Weight 359.180 g/mol
SMILES N1C(=O)N[C@]2([C@@]1(C[C@@](CNC(c1cc(Br)c[nH]1)=O)(O2)[H])OC)[H]
SPLASH splash10-00di-0903000000-3aee464a02a091ae80b7
Source of Spectrum F-68-2384-2
Wiley ID 1572028