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TIGLOYL-SHIKONIN
SpectraBase Compound ID EP8sTOdFPhI
InChI InChI=1S/C21H22O6/c1-5-12(4)21(26)27-17(9-6-11(2)3)13-10-16(24)18-14(22)7-8-15(23)19(18)20(13)25/h5-8,10,17,22-23H,9H2,1-4H3/b12-5+/t17-/m1/s1
InChIKey ZGQONWTUIANWFM-UPKKBRNCSA-N
Mol Weight 370.4 g/mol
Molecular Formula C21H22O6
Exact Mass 370.141638 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9d9tl2aIGll
Name TIGLOYL-SHIKONIN
Compound Number 9
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H22O6
InChI InChI=1S/C21H22O6/c1-5-12(4)21(26)27-17(9-6-11(2)3)13-10-16(24)18-14(22)7-8-15(23)19(18)20(13)25/h5-8,10,17,22-23H,9H2,1-4H3/b12-5+/t17-/m1/s1
InChIKey ZGQONWTUIANWFM-UPKKBRNCSA-N
Literature Reference Author Y.ITO,K.ONOBORI,T.YAMAZAKI,Y.KAWAMURA
Literature Reference Citation CHEM.PHARM.BULL.,59,117(2011)
Literature Reference DOI 10.1248/cpb.59.117
Molecular Weight 370.402 g/mol
Sample ID 2655
Solvent CDCl3