John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=8gs3yF3Y5qa SpectraBase Spectrum ID=10JJyrEaq2i

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6-OXOALSTOPHYLLINE
SpectraBase Compound ID 8gs3yF3Y5qa
InChI InChI=1S/C22H24N2O4/c1-11(25)15-9-28-10-16-14(15)8-18-21-19(22(26)20(16)24(18)3)13-6-5-12(27-4)7-17(13)23(21)2/h5-7,9,14,16,18,20H,8,10H2,1-4H3/t14-,16+,18-,20+/m0/s1
InChIKey RKVHXLFGCIDETB-RTBCOKGWSA-N
Mol Weight 380.44 g/mol
Molecular Formula C22H24N2O4
Exact Mass 380.173607 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 10JJyrEaq2i
Name 6-OXOALSTOPHYLLINE
Compound Number 9
Copyright Copyright © 2016-2021 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H24N2O4
InChI InChI=1S/C22H24N2O4/c1-11(25)15-9-28-10-16-14(15)8-18-21-19(22(26)20(16)24(18)3)13-6-5-12(27-4)7-17(13)23(21)2/h5-7,9,14,16,18,20H,8,10H2,1-4H3/t14-,16+,18-,20+/m0/s1
InChIKey RKVHXLFGCIDETB-RTBCOKGWSA-N
Literature Reference Author T.S.KAM,Y.M.CHOO
Literature Reference Citation J.NAT.PROD.,67,547(2004)
Literature Reference DOI 10.1021/np034041v
Molecular Weight 380.444 g/mol
Solvent CDCl3
Source File Reference UWMZ5512
SpectraBase Batch ID 591vMrcbRMo