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NICOTABALACTONECOSIDE;DIHYDRODEACETYL-PHYTUBERIN-2-ONE-11-O-BETA-D-GLUCOPYRANOSIDE
SpectraBase Compound ID 4p8JjcbtOh2
InChI InChI=1S/C21H34O9/c1-18(2,30-17-16(26)15(25)14(24)12(9-22)28-17)11-5-6-19(3)10-27-20(4)8-13(23)29-21(19,20)7-11/h11-12,14-17,22,24-26H,5-10H2,1-4H3/t11-,12+,14+,15-,16+,17-,19+,20-,21-/m1/s1
InChIKey UTOPWIBRGNPCLO-RRXVZJHJSA-N
Mol Weight 430.5 g/mol
Molecular Formula C21H34O9
Exact Mass 430.220283 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2vQMNQkQ7h2
Name NICOTABALACTONECOSIDE;DIHYDRODEACETYL-PHYTUBERIN-2-ONE-11-O-BETA-D-GLUCOPYRANOSIDE
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H34O9
InChI InChI=1S/C21H34O9/c1-18(2,30-17-16(26)15(25)14(24)12(9-22)28-17)11-5-6-19(3)10-27-20(4)8-13(23)29-21(19,20)7-11/h11-12,14-17,22,24-26H,5-10H2,1-4H3/t11-,12+,14+,15-,16+,17-,19+,20-,21-/m1/s1
InChIKey UTOPWIBRGNPCLO-RRXVZJHJSA-N
Literature Reference Author C.Y.YANG,C.A.GENG,Y.B.MA,X.Y.HUANG,X.M.ZHANG,J.ZHOU,J.J.CHEN
Literature Reference Citation J.AS.NAT.PROD.RES.,16,611(2014)
Literature Reference DOI 10.1080/10286020.2014.922553
Molecular Weight 430.496 g/mol
Solvent C5D5N
Source File Reference UWPA9183