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5-Deoxy-5-oxo-erythronolide B 5,9-hemiketale
SpectraBase Compound ID KPvBVxQOAJC
InChI InChI=1S/C21H36O7/c1-8-15-11(3)17(23)14(6)21(26)10(2)9-20(7,28-21)18(24)12(4)16(22)13(5)19(25)27-15/h10-17,22-23,26H,8-9H2,1-7H3
InChIKey HAMKPURALDTDFW-UHFFFAOYSA-N
Mol Weight 400.5 g/mol
Molecular Formula C21H36O7
Exact Mass 400.246103 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9bcXb1ASuyh
Name 5-Deoxy-5-oxo-erythronolide B 5,9-hemiketale
CAS Registry Number 57746-59-5
Copyright Copyright © 2002-2025 Wiley-VCH GmbH. All Rights Reserved.
Formula C21H36O7
InChI InChI=1S/C21H36O7/c1-8-15-11(3)17(23)14(6)21(26)10(2)9-20(7,28-21)18(24)12(4)16(22)13(5)19(25)27-15/h10-17,22-23,26H,8-9H2,1-7H3
InChIKey HAMKPURALDTDFW-UHFFFAOYSA-N
Instrument Name Varian HR-220
Literature Reference J.G. Nourse, J.D. Roberts, J. Am. Chem. Soc. 97, 4584 (1975).
NMR Standard CS2
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3