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TOMENTODIPLACONE_B
SpectraBase Compound ID HUOB2rMr24Y
InChI InChI=1S/C26H30O7/c1-15(6-5-11-26(2,3)31)7-9-17-19(28)13-23-24(25(17)30)20(29)14-21(33-23)16-8-10-18(27)22(12-16)32-4/h5,7-8,10-13,21,27-28,30-31H,6,9,14H2,1-4H3/b11-5+,15-7+/t21-/m0/s1
InChIKey SHWLJHMWQFNVAC-DETBAYCCSA-N
Mol Weight 454.52 g/mol
Molecular Formula C26H30O7
Exact Mass 454.199153 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BAP87Xuj36L
Name TOMENTODIPLACONE_B
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C26H30O7
InChI InChI=1S/C26H30O7/c1-15(6-5-11-26(2,3)31)7-9-17-19(28)13-23-24(25(17)30)20(29)14-21(33-23)16-8-10-18(27)22(12-16)32-4/h5,7-8,10-13,21,27-28,30-31H,6,9,14H2,1-4H3/b11-5+,15-7+/t21-/m0/s1
InChIKey SHWLJHMWQFNVAC-DETBAYCCSA-N
Literature Reference Author K.SMEJKAL,S.CHUDIK,P.KLOUCEK,R.MAREK,J.CVACKA,M.URBANOVA,O.J ULINEK,L.KOKOSKA,T.S
Literature Reference Citation J.NAT.PROD.,71,706(2008)
Literature Reference DOI 10.1021/np070446u
Molecular Weight 454.520 g/mol
Sample ID 28165
Solvent DMSO-D6