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ODORATIN-7-O-BETA-D-GLUCOPYRANOSIDE-PERACETYLATED

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ODORATIN-7-O-BETA-D-GLUCOPYRANOSIDE-PERACETYLATED
SpectraBase Compound ID JFRSNI5DtLx
InChI InChI=1S/C33H34O16/c1-15(34)42-14-28-30(45-17(3)36)31(46-18(4)37)32(47-19(5)38)33(49-28)48-27-12-24-21(11-25(27)41-7)29(39)22(13-43-24)20-8-9-23(40-6)26(10-20)44-16(2)35/h8-13,28,30-33H,14H2,1-7H3/t28-,30-,31+,32-,33-/m0/s1
InChIKey JCZYFHQESQSEBY-MUJVKIGASA-N
Mol Weight 686.6 g/mol
Molecular Formula C33H34O16
Exact Mass 686.184685 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CSzp2he2E1S
Name ODORATIN-7-O-BETA-D-GLUCOPYRANOSIDE-PERACETYLATED
Compound Number 1B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C33H34O16
InChI InChI=1S/C33H34O16/c1-15(34)42-14-28-30(45-17(3)36)31(46-18(4)37)32(47-19(5)38)33(49-28)48-27-12-24-21(11-25(27)41-7)29(39)22(13-43-24)20-8-9-23(40-6)26(10-20)44-16(2)35/h8-13,28,30-33H,14H2,1-7H3/t28-,30-,31+,32-,33-/m0/s1
InChIKey JCZYFHQESQSEBY-MUJVKIGASA-N
Literature Reference Author L.S.M.VELOZO,B.P.D.SILVA,R.R.BERNARDO,J.P.PARENTE
Literature Reference Citation PHYTOCHEM.,52,1473(1999)
Literature Reference DOI 10.1016/S0031-9422(99)00459-8
Molecular Weight 686.623 g/mol
Solvent DMSO-D6
Source File Reference UWVN208