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Rehmannioside D 5-O.beta.-sophorosylmonomelittoside
SpectraBase Compound ID Ah7IZFHodNW
InChI InChI=1S/C27H42O20/c28-4-8-3-12(32)27(1-2-41-23(13(8)27)46-25-21(40)18(37)15(34)10(6-30)43-25)47-26-22(19(38)16(35)11(7-31)44-26)45-24-20(39)17(36)14(33)9(5-29)42-24/h1-3,9-26,28-40H,4-7H2/t9-,10-,11?,12?,13?,14-,15-,16?,17+,18+,19?,20-,21-,22?,23?,24+,25+,26?,27?/m0/s1
InChIKey JQEFRKPLHFKTFL-OPJJEYIWSA-N
Mol Weight 686.6 g/mol
Molecular Formula C27H42O20
Exact Mass 686.226944 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IFQiDCWVQ8a
Name Rehmannioside D 5-O.beta.-sophorosylmonomelittoside
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Formula C27H42O20
InChI InChI=1S/C27H42O20/c28-4-8-3-12(32)27(1-2-41-23(13(8)27)46-25-21(40)18(37)15(34)10(6-30)43-25)47-26-22(19(38)16(35)11(7-31)44-26)45-24-20(39)17(36)14(33)9(5-29)42-24/h1-3,9-26,28-40H,4-7H2/t9-,10-,11?,12?,13?,14-,15-,16?,17+,18+,19?,20-,21-,22?,23?,24+,25+,26?,27?/m0/s1
InChIKey JQEFRKPLHFKTFL-OPJJEYIWSA-N
Literature Reference H. Oshio, H. Inouye, Phytochem. 21, 133 (1982).
NMR Standard Dioxane
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent D2O