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BALANOPHONIN-E;1',9'-DIHYDROXY-2,2'-DIMETHOXY-8'-METHOXY-1,7'-OXO-PHENYL-PROPYL-CONIFERALDEHYDE
SpectraBase Compound ID Ka2Ozx8BP6y
InChI InChI=1S/C21H24O7/c1-25-18-12-15(7-8-16(18)24)21(20(13-23)27-3)28-17-9-6-14(5-4-10-22)11-19(17)26-2/h4-12,20-21,23-24H,13H2,1-3H3/b5-4+/t20-,21+/m1/s1
InChIKey OXIOOSQVRKLEPO-KWFAIERBSA-N
Mol Weight 388.42 g/mol
Molecular Formula C21H24O7
Exact Mass 388.152203 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JHYeDr7dN6i
Name BALANOPHONIN-E;1',9'-DIHYDROXY-2,2'-DIMETHOXY-8'-METHOXY-1,7'-OXO-PHENYL-PROPYL-CONIFERALDEHYDE
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H24O7
InChI InChI=1S/C21H24O7/c1-25-18-12-15(7-8-16(18)24)21(20(13-23)27-3)28-17-9-6-14(5-4-10-22)11-19(17)26-2/h4-12,20-21,23-24H,13H2,1-3H3/b5-4+/t20-,21+/m1/s1
InChIKey OXIOOSQVRKLEPO-KWFAIERBSA-N
Literature Reference Author Y.XIE,G.MA,H.WEI,J.YUAN,H.WU,X.ZHOU,J.YANG,X.XU
Literature Reference Citation MOLECULES,18,10397(2013)
Literature Reference DOI 10.3390/molecules180910397
Molecular Weight 388.417 g/mol
Solvent CD3OD
Source File Reference UWIR9314