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OXYSTEMOKERRIN-N-OXIDE;4-METHOXY-3-METHYL-5-[(2Z,11AS)-3AT,11T-EPOXY-8T-[(1R)-1-HYDROXYPROPYL]-1C-METHYL-(11AR,11BC)-DODECAHYDRO-FURO-[3,2-C]-PYRID

View entire compound with spectra: 3 NMR

OXYSTEMOKERRIN-N-OXIDE;4-METHOXY-3-METHYL-5-[(2Z,11AS)-3AT,11T-EPOXY-8T-[(1R)-1-HYDROXYPROPYL]-1C-METHYL-(11AR,11BC)-DODECAHYDRO-FURO-[3,2-C]-PYRID
SpectraBase Compound ID B5fIL2Xb0FC
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-HEWGMWAJSA-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 BTIapZJot88
Name OXYSTEMOKERRIN-N-OXIDE;4-METHOXY-3-METHYL-5-[(2Z,11AS)-3AT,11T-EPOXY-8T-[(1R)-1-HYDROXYPROPYL]-1C-METHYL-(11AR,11BC)-DODECAHYDRO-FURO-[3,2-C]-PYRID
Compound Number 4
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-HEWGMWAJSA-N
Literature Reference Author E.KALTENEGGER,B.BREM,K.MEREITER,H.KALCHHAUSER,H.KAEHLIG,O.HO FER,S.VAJRODAYA,H.GR
Literature Reference Citation PHYTOCHEM.,63,803(2003)
Literature Reference DOI 10.1016/S0031-9422(03)00332-7
Molecular Weight 421.491 g/mol
Solvent CDCl3
Source File Reference UWVN27109