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VITISINOL_A
SpectraBase Compound ID FW3DAjuygk3
InChI InChI=1S/C28H20O6/c29-15-5-1-13(2-6-15)27-25-19-9-17(31)11-21-23(19)24-20(10-18(32)12-22(24)33-21)26(25)28(34-27)14-3-7-16(30)8-4-14/h1-12,25-32H/t25-,26+,27+,28-
InChIKey MZWZALRDXMEEEK-KXSOJQAOSA-N
Mol Weight 452.46 g/mol
Molecular Formula C28H20O6
Exact Mass 452.125988 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CLyZizrEOIs
Name VITISINOL_A
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C28H20O6
InChI InChI=1S/C28H20O6/c29-15-5-1-13(2-6-15)27-25-19-9-17(31)11-21-23(19)24-20(10-18(32)12-22(24)33-21)26(25)28(34-27)14-3-7-16(30)8-4-14/h1-12,25-32H/t25-,26+,27+,28-
InChIKey MZWZALRDXMEEEK-KXSOJQAOSA-N
Literature Reference Author Y.L.HUANG,W.J.TSAI,C.C.SHEN,C.C.CHEN
Literature Reference Citation J.NAT.PROD.,68,217(2005)
Literature Reference DOI 10.1021/np049686p
Molecular Weight 452.463 g/mol
Solvent CD3OD
Source File Reference UWMZ8880