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ISOPHYSALIN-B
SpectraBase Compound ID 3wJWsuXyvpF
InChI InChI=1S/C28H30O9/c1-23-11-18-25(3)28-19(23)20(30)27(37-28,34-12-16(23)21(31)35-18)15-8-7-13-5-4-6-17(29)24(13,2)14(15)9-10-26(28,33)22(32)36-25/h4-5,7,14-16,18-19,33H,6,8-12H2,1-3H3/t14-,15+,16-,18+,19+,23+,24-,25-,26+,27-,28-/m0/s1
InChIKey HRUAQJXBUYEBPK-OVDJBWHPSA-N
Mol Weight 510.54 g/mol
Molecular Formula C28H30O9
Exact Mass 510.188983 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3amzSPO1Qsg
Name ISOPHYSALIN-B
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C28H30O9
InChI InChI=1S/C28H30O9/c1-23-11-18-25(3)28-19(23)20(30)27(37-28,34-12-16(23)21(31)35-18)15-8-7-13-5-4-6-17(29)24(13,2)14(15)9-10-26(28,33)22(32)36-25/h4-5,7,14-16,18-19,33H,6,8-12H2,1-3H3/t14-,15+,16-,18+,19+,23+,24-,25-,26+,27-,28-/m0/s1
InChIKey HRUAQJXBUYEBPK-OVDJBWHPSA-N
Literature Reference Author M.I.CHOUDHARY,S.YOUSUF,SAMREEN,S.A.A.SHAH,S.AHMED,A.U.RAHMAN
Literature Reference Citation CHEM.PHARM.BULL.,54,927(2006)
Literature Reference DOI 10.1248/cpb.54.927
Molecular Weight 510.541 g/mol
Sample ID 46137
Solvent CDCl3