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Ilexoside-B,methylester
SpectraBase Compound ID 1R8T6zcfITz
InChI InChI=1S/C36H58O8/c1-20-11-16-36(30(40)42-8)18-17-33(5)21(28(36)35(20,7)41)9-10-24-32(4)14-13-25(31(2,3)23(32)12-15-34(24,33)6)44-29-27(39)26(38)22(37)19-43-29/h9,20,22-29,37-39,41H,10-19H2,1-8H3/t20-,22-,23?,24?,25+,26+,27-,28?,29+,32+,33-,34-,35-,36+/m1/s1
InChIKey ZCWVJVNYHGWIEF-QEAUCFRFSA-N
Mol Weight 618.9 g/mol
Molecular Formula C36H58O8
Exact Mass 618.413169 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HEcOMwBxlXk
Name ILEXOSIDE-B,METHYLESTER
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C36H58O8
InChI InChI=1S/C36H58O8/c1-20-11-16-36(30(40)42-8)18-17-33(5)21(28(36)35(20,7)41)9-10-24-32(4)14-13-25(31(2,3)23(32)12-15-34(24,33)6)44-29-27(39)26(38)22(37)19-43-29/h9,20,22-29,37-39,41H,10-19H2,1-8H3/t20-,22-,23?,24?,25+,26+,27-,28?,29+,32+,33-,34-,35-,36+/m1/s1
InChIKey ZCWVJVNYHGWIEF-QEAUCFRFSA-N
Literature Reference Author A.INADA,M.KOBAYASHI,H.MURATA,T.NAKANISHI
Literature Reference Citation CHEM.PHARM.BULL.,35,841(1987)
Literature Reference DOI 10.1248/cpb.35.841
Molecular Weight 618.852 g/mol
Solvent PYRIDINE-D5
Source File Reference UWBK218