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STEMOCURTISINOL_N-OXIDE

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STEMOCURTISINOL_N-OXIDE
SpectraBase Compound ID DtVwEotHFmo
InChI InChI=1S/C22H31NO7/c1-5-14(24)13-7-8-15-17-16-11(2)19(20-18(27-4)12(3)21(25)28-20)30-22(16,29-15)9-6-10-23(13,17)26/h11,13-17,24H,5-10H2,1-4H3/b20-19-/t11-,13-,14-,15-,16+,17-,22-,23-/m0/s1
InChIKey GQHSQVDONZAQMO-OJGSGPCJSA-N
Mol Weight 421.49 g/mol
Molecular Formula C22H31NO7
Exact Mass 421.210052 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3ZJlwMjd9yk
Name STEMOCURTISINOL_N-OXIDE
Compound Number 16
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H31NO7
InChI InChI=1S/C22H31NO7/c1-5-14(24)13-7-8-15-17-16-11(2)19(20-18(27-4)12(3)21(25)28-20)30-22(16,29-15)9-6-10-23(13,17)26/h11,13-17,24H,5-10H2,1-4H3/b20-19-/t11-,13-,14-,15-,16+,17-,22-,23-/m0/s1
InChIKey GQHSQVDONZAQMO-OJGSGPCJSA-N
Literature Reference Author S.CHAIYONG,A.JATISATIENR,P.MUNGKORNASAWAKUL,T.SASTRARUJI,S.G .PYNE,A.T.UNG,T.URAT
Literature Reference Citation J.NAT.PROD.,73,1833(2010)
Literature Reference DOI 10.1021/np100474y
Molecular Weight 421.491 g/mol
Sample ID 37003
Solvent CDCl3