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Mulberoside A - decamethyl ether
SpectraBase Compound ID AbgUKwCbHdL
InChI InChI=1S/C36H52O14/c1-37-19-27-29(41-5)31(43-7)33(45-9)35(49-27)47-23-14-13-22(26(18-23)40-4)12-11-21-15-24(39-3)17-25(16-21)48-36-34(46-10)32(44-8)30(42-6)28(50-36)20-38-2/h11-18,27-36H,19-20H2,1-10H3/b12-11+
InChIKey OWNJZPULERHFFS-VAWYXSNFSA-N
Mol Weight 708.8 g/mol
Molecular Formula C36H52O14
Exact Mass 708.335706 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CYDjKwmGMmK
Name Mulberoside A - decamethyl ether
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C36H52O14
InChI InChI=1S/C36H52O14/c1-37-19-27-29(41-5)31(43-7)33(45-9)35(49-27)47-23-14-13-22(26(18-23)40-4)12-11-21-15-24(39-3)17-25(16-21)48-36-34(46-10)32(44-8)30(42-6)28(50-36)20-38-2/h11-18,27-36H,19-20H2,1-10H3/b12-11+
InChIKey OWNJZPULERHFFS-VAWYXSNFSA-N
Molecular Weight 708.798 g/mol
SMILES C1(C(C(OC)C(C(O1)COC)OC)OC)Oc1cc(OC)cc(\C=C\c2c(cc(OC3C(C(OC)C(C(O3)COC)OC)OC)cc2)OC)c1
SPLASH splash10-0pbi-0920500100-1650f4a8cfe64ce0205e
Source of Spectrum X2-49-222-1
Wiley ID 1601859