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CALANTHOSIDE;3-O-BETA-D-GLUCOPYRANOSYL-2-S-BETA-D-GLUCOPYRANOSYL-INDOLE
SpectraBase Compound ID HCGLbU1c0Xl
InChI InChI=1S/C20H27NO11S/c22-5-9-11(24)13(26)15(28)19(30-9)32-17-7-3-1-2-4-8(7)21-18(17)33-20-16(29)14(27)12(25)10(6-23)31-20/h1-4,9-16,19-29H,5-6H2/t9-,10-,11-,12-,13+,14+,15-,16-,19+,20+/m1/s1
InChIKey RPMOMKUYGKLDSQ-SHJINENGSA-N
Mol Weight 489.49 g/mol
Molecular Formula C20H27NO11S
Exact Mass 489.130482 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7A3kcSNMqL
Name CALANTHOSIDE;3-O-BETA-D-GLUCOPYRANOSYL-2-S-BETA-D-GLUCOPYRANOSYL-INDOLE
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H27NO11S
InChI InChI=1S/C20H27NO11S/c22-5-9-11(24)13(26)15(28)19(30-9)32-17-7-3-1-2-4-8(7)21-18(17)33-20-16(29)14(27)12(25)10(6-23)31-20/h1-4,9-16,19-29H,5-6H2/t9-,10-,11-,12-,13+,14+,15-,16-,19+,20+/m1/s1
InChIKey RPMOMKUYGKLDSQ-SHJINENGSA-N
Literature Reference Author M.YOSHIKAWA,T.MURAKAMI,A.KISHI,T.SAKURAMA,H.MATSUDA,M.NOMURA ,H.MATSUDA,M.KUBO
Literature Reference Citation CHEM.PHARM.BULL.,46,886(1998)
Literature Reference DOI 10.1248/cpb.46.886
Molecular Weight 489.494 g/mol
Solvent CD3OD
Source File Reference UWMS6466