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PLUMBAGOSIDE_B;PLUMBAGINE_E-ALPHA-D-XYLOSIDE
SpectraBase Compound ID GGX0IKV2PYb
InChI InChI=1S/C20H35N3O9/c1-11(9-24)3-2-4-13(18(29)30)14-8-23(20(21)22-14)7-12(25)5-6-31-19-17(28)16(27)15(26)10-32-19/h3,12-17,19,24-28H,2,4-10H2,1H3,(H2,21,22)(H,29,30)/b11-3-/t12?,13-,14+,15+,16-,17+,19-/m1/s1
InChIKey CTAOPGCXFVDOPY-RIGQPWNUSA-N
Mol Weight 461.5 g/mol
Molecular Formula C20H35N3O9
Exact Mass 461.23733 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Em7rjNegpgZ
Name PLUMBAGOSIDE_B;PLUMBAGINE_E-ALPHA-D-XYLOSIDE
Compound Number 10
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H35N3O9
InChI InChI=1S/C20H35N3O9/c1-11(9-24)3-2-4-13(18(29)30)14-8-23(20(21)22-14)7-12(25)5-6-31-19-17(28)16(27)15(26)10-32-19/h3,12-17,19,24-28H,2,4-10H2,1H3,(H2,21,22)(H,29,30)/b11-3-/t12?,13-,14+,15+,16-,17+,19-/m1/s1
InChIKey CTAOPGCXFVDOPY-RIGQPWNUSA-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 461.513 g/mol
Sample ID 42734
Solvent CD3OD