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12-ACETYL-13-N-BUTANOYLALCYOPTEROSIN_D
SpectraBase Compound ID 9JsIb3oI7Li
InChI InChI=1S/C21H29ClO4/c1-5-6-20(24)26-12-16-9-15-10-21(3,4)11-18(15)19(13-25-14(2)23)17(16)7-8-22/h9H,5-8,10-13H2,1-4H3
InChIKey JIWBAUQSVZNFSA-UHFFFAOYSA-N
Mol Weight 380.91 g/mol
Molecular Formula C21H29ClO4
Exact Mass 380.175437 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9mISD70WsLm
Name 12-ACETYL-13-N-BUTANOYLALCYOPTEROSIN_D
Compound Number 5
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H29ClO4
InChI InChI=1S/C21H29ClO4/c1-5-6-20(24)26-12-16-9-15-10-21(3,4)11-18(15)19(13-25-14(2)23)17(16)7-8-22/h9H,5-8,10-13H2,1-4H3
InChIKey JIWBAUQSVZNFSA-UHFFFAOYSA-N
Literature Reference Author M.CARBONE,L.NUNEZ-PONS,F.CASTELLUCCIO,C.AVILA,M.GAVAGNIN
Literature Reference Citation J.NAT.PROD.,72,1357(2009)
Literature Reference DOI 10.1021/np900162t
Molecular Weight 380.912 g/mol
Sample ID 33267
Solvent CDCl3