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ACUTOSIDE-B;(-)-(7R,8S,7'E)-4-HYDROXY-3,3'-DIMETHOXY-7,4'-EPOXY-8,5'-NEOLIGN-7'-ENE-9,9'-DIOL-9-ETHYLETHER-9'-O-BETA-D-GLUCOPYRANOSIDE
SpectraBase Compound ID JMC30RmADmB
InChI InChI=1S/C28H36O11/c1-4-36-14-18-17-10-15(6-5-9-37-28-25(33)24(32)23(31)22(13-29)38-28)11-21(35-3)27(17)39-26(18)16-7-8-19(30)20(12-16)34-2/h5-8,10-12,18,22-26,28-33H,4,9,13-14H2,1-3H3/b6-5+/t18-,22+,23+,24-,25+,26+,28+/m1/s1
InChIKey WHHDSCWULZOSOA-OABLXSTISA-N
Mol Weight 548.6 g/mol
Molecular Formula C28H36O11
Exact Mass 548.225762 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FEZw9wkreIP
Name ACUTOSIDE-B;(-)-(7R,8S,7'E)-4-HYDROXY-3,3'-DIMETHOXY-7,4'-EPOXY-8,5'-NEOLIGN-7'-ENE-9,9'-DIOL-9-ETHYLETHER-9'-O-BETA-D-GLUCOPYRANOSIDE
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C28H36O11
InChI InChI=1S/C28H36O11/c1-4-36-14-18-17-10-15(6-5-9-37-28-25(33)24(32)23(31)22(13-29)38-28)11-21(35-3)27(17)39-26(18)16-7-8-19(30)20(12-16)34-2/h5-8,10-12,18,22-26,28-33H,4,9,13-14H2,1-3H3/b6-5+/t18-,22+,23+,24-,25+,26+,28+/m1/s1
InChIKey WHHDSCWULZOSOA-OABLXSTISA-N
Literature Reference Author Y.YU,Z.B.WANG,Y.D.ZHAI,P.Y.SONG,Q.H.WANG,B.Y.YANG,H.X.KUANG
Literature Reference Citation REC.NAT.PROD.,8,234(2014)
Molecular Weight 548.587 g/mol
Solvent CD3OD
Source File Reference UWIR16014