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COMAZAPHILONE_D
SpectraBase Compound ID JJxEHScM0g7
InChI InChI=1S/C21H22O7/c1-4-5-14-7-12-8-17(21(3,26)19(24)15(12)10-27-14)28-20(25)18-11(2)6-13(22)9-16(18)23/h4-7,9,17,22-23,26H,8,10H2,1-3H3/b5-4+/t17-,21-/m1/s1
InChIKey GIROBNCADSJPIJ-OQBWYENPSA-N
Mol Weight 386.4 g/mol
Molecular Formula C21H22O7
Exact Mass 386.136553 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID F2ZozzZ0qKw
Name COMAZAPHILONE_D
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H22O7
InChI InChI=1S/C21H22O7/c1-4-5-14-7-12-8-17(21(3,26)19(24)15(12)10-27-14)28-20(25)18-11(2)6-13(22)9-16(18)23/h4-7,9,17,22-23,26H,8,10H2,1-3H3/b5-4+/t17-,21-/m1/s1
InChIKey GIROBNCADSJPIJ-OQBWYENPSA-N
Literature Reference Author S.S.GAO,X.M.LI,Y.ZHANG,C.S.LI,C.M.CUI,B.G.WANG
Literature Reference Citation J.NAT.PROD.,74,256(2011)
Literature Reference DOI 10.1021/np100788h
Molecular Weight 386.401 g/mol
Sample ID 37501
Solvent CDCl3