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CUMINOSIDE-A;(1S,5S,6S,10S)-10-HYDROXYGUAIA-3,7(11)-DIEN-12,6-OLIDE-BETA-D-GLUCOPYRANOSIDE
SpectraBase Compound ID 3Jto6V0Fm29
InChI InChI=1S/C21H30O8/c1-9-4-5-12-14(9)18-11(10(2)19(26)28-18)6-7-21(12,3)29-20-17(25)16(24)15(23)13(8-22)27-20/h4,12-18,20,22-25H,5-8H2,1-3H3/t12-,13+,14+,15+,16-,17+,18+,20-,21-/m0/s1
InChIKey WHKZFBZPPKMCMS-OLWLSHKLSA-N
Mol Weight 410.46 g/mol
Molecular Formula C21H30O8
Exact Mass 410.194068 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3xtvMgxFoyA
Name CUMINOSIDE-A;(1S,5S,6S,10S)-10-HYDROXYGUAIA-3,7(11)-DIEN-12,6-OLIDE-BETA-D-GLUCOPYRANOSIDE
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H30O8
InChI InChI=1S/C21H30O8/c1-9-4-5-12-14(9)18-11(10(2)19(26)28-18)6-7-21(12,3)29-20-17(25)16(24)15(23)13(8-22)27-20/h4,12-18,20,22-25H,5-8H2,1-3H3/t12-,13+,14+,15+,16-,17+,18+,20-,21-/m0/s1
InChIKey WHKZFBZPPKMCMS-OLWLSHKLSA-N
Literature Reference Author T.TAKAYANAGI,T.ISHIKAWA,J.KITAJIMA
Literature Reference Citation PHYTOCHEM.,63,479(2003)
Literature Reference DOI 10.1016/s0031-9422(03)00103-1
Molecular Weight 410.464 g/mol
Solvent C5D5N
Source File Reference UWVN27025