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(TRANS)-EMODIN-PHYSCION_BIANTHRONE
SpectraBase Compound ID EYb7UEpJ9xI
InChI InChI=1S/C31H24O8/c1-12-4-16-24(18-8-14(32)9-22(35)28(18)30(37)26(16)20(33)6-12)25-17-5-13(2)7-21(34)27(17)31(38)29-19(25)10-15(39-3)11-23(29)36/h4-11,24-25,32-36H,1-3H3/t24-,25+/m0/s1
InChIKey LWKILGBKGWRERU-LOSJGSFVSA-N
Mol Weight 524.53 g/mol
Molecular Formula C31H24O8
Exact Mass 524.147118 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4jW08f7YpEE
Name (TRANS)-EMODIN-PHYSCION_BIANTHRONE
Compound Number 16
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C31H24O8
InChI InChI=1S/C31H24O8/c1-12-4-16-24(18-8-14(32)9-22(35)28(18)30(37)26(16)20(33)6-12)25-17-5-13(2)7-21(34)27(17)31(38)29-19(25)10-15(39-3)11-23(29)36/h4-11,24-25,32-36H,1-3H3/t24-,25+/m0/s1
InChIKey LWKILGBKGWRERU-LOSJGSFVSA-N
Literature Reference Author L.DU,T.ZHU,H.LIU,Y.FANG,W.ZHU,Q.GU
Literature Reference Citation J.NAT.PROD.,71,1837(2008)
Literature Reference DOI 10.1021/np800303t
Molecular Weight 524.527 g/mol
Sample ID 29258
Solvent ACETONE-D6