SpectraBase Compound ID | 6snAjiv6Uu5 |
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InChI | InChI=1S/C20H26O12/c1-7-2-3-10(12-8(7)4-28-18(12)27)31-20-17(26)15(24)14(23)11(32-20)6-30-19-16(25)13(22)9(21)5-29-19/h2-3,9,11,13-17,19-26H,4-6H2,1H3/t9-,11+,13-,14+,15-,16+,17+,19-,20+/m1/s1 |
InChIKey | QSTWATBAAMDBSL-WLCJXIKRSA-N |
Mol Weight | 458.42 g/mol |
Molecular Formula | C20H26O12 |
Exact Mass | 458.142426 g/mol |
SpectraBase Spectrum ID | 82D9Tw9AEiq |
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Name | 7-O-[BETA-GLUCOPYRANOSYL-(1->6)-BETA-ARABINOPYRANOSYL]-7-HYDROXY-4-METHYL-1-[3H]-ISOBENZOFURANONE |
Compound Number | 1 |
Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
Formula | C20H26O12 |
InChI | InChI=1S/C20H26O12/c1-7-2-3-10(12-8(7)4-28-18(12)27)31-20-17(26)15(24)14(23)11(32-20)6-30-19-16(25)13(22)9(21)5-29-19/h2-3,9,11,13-17,19-26H,4-6H2,1H3/t9-,11+,13-,14+,15-,16+,17+,19-,20+/m1/s1 |
InChIKey | QSTWATBAAMDBSL-WLCJXIKRSA-N |
Literature Reference Author | C.STEINBECK,C.SCHNEIDER,K.ROTSCHEIDT,E.BREITMAIER |
Literature Reference Citation | PHYTOCHEM.,40,1313(1995) |
Literature Reference DOI | 10.1016/0031-9422(95)00496-T |
Molecular Weight | 458.419 g/mol |
Solvent | D2O:CD3OD |
Source File Reference | UWMS2877 |