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5A-(ACETOXY)-METHYLDIHYDROBICYCLOMYCIN-C-(2'),C-(3')-ACETONIDE
SpectraBase Compound ID J8ZXHRNzvts
InChI InChI=1S/C18H28N2O9/c1-10(21)26-7-5-11-6-8-27-18(14(24)19-17(11,25)13(23)20-18)12(22)16(4)9-28-15(2,3)29-16/h11-12,22,25H,5-9H2,1-4H3,(H,19,24)(H,20,23)/t11-,12?,16?,17+,18-/m1/s1
InChIKey QFOPZCGJECFNHB-LBPKGIKKSA-N
Mol Weight 416.43 g/mol
Molecular Formula C18H28N2O9
Exact Mass 416.17948 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2ReFF5Lc9z8
Name 5A-(ACETOXY)-METHYLDIHYDROBICYCLOMYCIN-C-(2'),C-(3')-ACETONIDE
Compound Number 55
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H28N2O9
InChI InChI=1S/C18H28N2O9/c1-10(21)26-7-5-11-6-8-27-18(14(24)19-17(11,25)13(23)20-18)12(22)16(4)9-28-15(2,3)29-16/h11-12,22,25H,5-9H2,1-4H3,(H,19,24)(H,20,23)/t11-,12?,16?,17+,18-/m1/s1
InChIKey QFOPZCGJECFNHB-LBPKGIKKSA-N
Literature Reference Author F.VINCENT,J.SRINIVASAN,A.SANTILLAN,W.R.WIDGER,H.KOHN
Literature Reference Citation J.ORG.CHEM.,66,2251(2001)
Literature Reference DOI 10.1021/jo0013150
Molecular Weight 416.428 g/mol
Solvent CD3OD
Source File Reference UWLU26264