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TRIPHYLLIN_A
SpectraBase Compound ID 3G1Tv19OdMH
InChI InChI=1S/C30H40O16/c1-11-26(45-29-24(39)22(37)20(35)17(9-32)43-29)14(8-31)28(46-30-25(40)23(38)21(36)18(10-33)44-30)19-15(34)7-16(42-27(11)19)12-3-5-13(41-2)6-4-12/h3-6,15-18,20-25,29-40H,7-10H2,1-2H3/t15-,16+,17-,18-,20-,21-,22+,23+,24-,25-,29+,30+/m1/s1
InChIKey KIOGDCNEFKPDDB-HSKOKGOGSA-N
Mol Weight 656.6 g/mol
Molecular Formula C30H40O16
Exact Mass 656.231635 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6TyAePSj8gk
Name TRIPHYLLIN_A
Compound Number 5
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C30H40O16
InChI InChI=1S/C30H40O16/c1-11-26(45-29-24(39)22(37)20(35)17(9-32)43-29)14(8-31)28(46-30-25(40)23(38)21(36)18(10-33)44-30)19-15(34)7-16(42-27(11)19)12-3-5-13(41-2)6-4-12/h3-6,15-18,20-25,29-40H,7-10H2,1-2H3/t15-,16+,17-,18-,20-,21-,22+,23+,24-,25-,29+,30+/m1/s1
InChIKey KIOGDCNEFKPDDB-HSKOKGOGSA-N
Literature Reference Author Z.ZHAO,J.RUAN,J.JIN,J.ZOU,D.ZHOU,W.FANG,F.ZENG
Literature Reference Citation J.NAT.PROD.,69,265(2006)
Literature Reference DOI 10.1021/np050191p
Molecular Weight 656.638 g/mol
Solvent DMSO-D6
Source File Reference UWMZ16992