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PLUMBAGOSIDE_A;PLUMBAGINE_D-ALPHA-D-XYLOSIDE
SpectraBase Compound ID F77Yc4PNRWj
InChI InChI=1S/C20H35N3O8/c1-11(2)4-3-5-13(18(28)29)14-9-23(20(21)22-14)8-12(24)6-7-30-19-17(27)16(26)15(25)10-31-19/h4,12-17,19,24-27H,3,5-10H2,1-2H3,(H2,21,22)(H,28,29)/t12?,13-,14+,15+,16-,17+,19-/m1/s1
InChIKey UZGVQXUOHSUMJU-OXSLJINYSA-N
Mol Weight 445.5 g/mol
Molecular Formula C20H35N3O8
Exact Mass 445.242415 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6Xe544Inxki
Name PLUMBAGOSIDE_A;PLUMBAGINE_D-ALPHA-D-XYLOSIDE
Compound Number 9
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H35N3O8
InChI InChI=1S/C20H35N3O8/c1-11(2)4-3-5-13(18(28)29)14-9-23(20(21)22-14)8-12(24)6-7-30-19-17(27)16(26)15(25)10-31-19/h4,12-17,19,24-27H,3,5-10H2,1-2H3,(H2,21,22)(H,28,29)/t12?,13-,14+,15+,16-,17+,19-/m1/s1
InChIKey UZGVQXUOHSUMJU-OXSLJINYSA-N
Literature Reference Author H.J.CONG,S.W.ZHANG,Y.SHEN,Y.ZHENG,Y.J.HUANG,W.Q.WANG,Y.LENG, L.J.XUAN
Literature Reference Citation J.NAT.PROD.,76,1351(2013)
Literature Reference DOI 10.1021/np400235s
Molecular Weight 445.513 g/mol
Sample ID 42731
Solvent CD3OD