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CITRIFOLININ-A
SpectraBase Compound ID ITGWtcJpx1z
InChI InChI=1S/C27H30O16/c1-38-16-7-11(3-4-15(16)29)13(22(33)34)9-41-26(36)27(37)6-5-12-14(23(35)39-2)10-40-24(18(12)27)43-25-21(32)20(31)19(30)17(8-28)42-25/h3-7,9-10,12,17-21,24-25,28-32,37H,8H2,1-2H3,(H,33,34)/b13-9-/t12-,17+,18-,19+,20-,21+,24+,25-,27+/m1/s1
InChIKey CLSONMZJGDJYSR-ZHSHONKTSA-N
Mol Weight 610.52 g/mol
Molecular Formula C27H30O16
Exact Mass 610.153385 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9QQqJR5pnr0
Name CITRIFOLININ-A
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C27H30O16
InChI InChI=1S/C27H30O16/c1-38-16-7-11(3-4-15(16)29)13(22(33)34)9-41-26(36)27(37)6-5-12-14(23(35)39-2)10-40-24(18(12)27)43-25-21(32)20(31)19(30)17(8-28)42-25/h3-7,9-10,12,17-21,24-25,28-32,37H,8H2,1-2H3,(H,33,34)/b13-9-/t12-,17+,18-,19+,20-,21+,24+,25-,27+/m1/s1
InChIKey CLSONMZJGDJYSR-ZHSHONKTSA-N
Literature Reference Author J.SCHRIPSEMA,G.P.CAPRINI,D.DAGNINO
Literature Reference Citation ORG.LETTERS,8,5337(2006)
Literature Reference DOI 10.1021/ol0622108
Molecular Weight 610.526 g/mol
Sample ID 53330
Solvent Unknown