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PHYLLANEMBLININ-F;6-O-NEOCHEBULOYL-1-O-GALLOYL-BETA-D-GLUCOSE
SpectraBase Compound ID 2MRyEQ9WO3Y
InChI InChI=1S/C27H26O20/c28-9-1-6(2-10(29)16(9)33)24(41)47-27-21(38)20(37)18(35)12(45-27)5-44-25(42)8(4-13(31)32)15-14-7(3-11(30)17(34)19(14)36)26(43)46-22(15)23(39)40/h1-3,8,12,15,18,20-22,27-30,33-38H,4-5H2,(H,31,32)(H,39,40)/t8-,12+,15+,18+,20-,21+,22+,27-/m1/s1
InChIKey BNFJLSCQEIACTE-QYYAYUHDSA-N
Mol Weight 670.48 g/mol
Molecular Formula C27H26O20
Exact Mass 670.101743 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5dFDrrH0EPB
Name PHYLLANEMBLININ-F;6-O-NEOCHEBULOYL-1-O-GALLOYL-BETA-D-GLUCOSE
Compound Number 6
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C27H26O20
InChI InChI=1S/C27H26O20/c28-9-1-6(2-10(29)16(9)33)24(41)47-27-21(38)20(37)18(35)12(45-27)5-44-25(42)8(4-13(31)32)15-14-7(3-11(30)17(34)19(14)36)26(43)46-22(15)23(39)40/h1-3,8,12,15,18,20-22,27-30,33-38H,4-5H2,(H,31,32)(H,39,40)/t8-,12+,15+,18+,20-,21+,22+,27-/m1/s1
InChIKey BNFJLSCQEIACTE-QYYAYUHDSA-N
Literature Reference Author Y.J.ZHANG,T.ABE,T.TANAKA,C.R.YANG,I.KOUNO
Literature Reference Citation J.NAT.PROD.,64,1527(2001)
Literature Reference DOI 10.1021/np010370g
Molecular Weight 670.491 g/mol
Solvent ACETONE-D6
Source File Reference UWSI2395