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CAESAPPANIN-B

View entire compound with spectra: 1 NMR

CAESAPPANIN-B
SpectraBase Compound ID KwQGJjMt9Vd
InChI InChI=1S/C30H28O10/c31-17-1-3-21-23-11-27(37)25(35)7-15(23)5-19(33)14-40-30-10-18(32)2-4-22(30)24-12-28(38)26(36)8-16(24)6-20(34)13-39-29(21)9-17/h1-4,7-12,19-20,31-38H,5-6,13-14H2/t19-,20-/m0/s1
InChIKey GQBUKSNOXRRSSA-PMACEKPBSA-N
Mol Weight 548.54 g/mol
Molecular Formula C30H28O10
Exact Mass 548.168247 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID K7SCotaXB0K
Name CAESAPPANIN-B
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C30H28O10
InChI InChI=1S/C30H28O10/c31-17-1-3-21-23-11-27(37)25(35)7-15(23)5-19(33)14-40-30-10-18(32)2-4-22(30)24-12-28(38)26(36)8-16(24)6-20(34)13-39-29(21)9-17/h1-4,7-12,19-20,31-38H,5-6,13-14H2/t19-,20-/m0/s1
InChIKey GQBUKSNOXRRSSA-PMACEKPBSA-N
Literature Reference Author S.H.SHU,A.J.DENG,Z.H.LI,H.L.QIN
Literature Reference Citation FITOTERAPIA,82,762(2011)
Literature Reference DOI 10.1016/j.fitote.2011.03.010
Molecular Weight 548.546 g/mol
Solvent DMSO-D6
Source File Reference UWDB1037