| SpectraBase Compound ID | Hge9GtGCS0B |
|---|---|
| InChI | InChI=1S/C26H28O14/c27-6-13-18(32)21(35)23(37)26(40-13)15-19(33)14-10(29)5-12(8-1-3-9(28)4-2-8)39-24(14)16(20(15)34)25-22(36)17(31)11(30)7-38-25/h1-5,11,13,17-18,21-23,25-28,30-37H,6-7H2 |
| InChIKey | MMDUKUSNQNWVET-UHFFFAOYSA-N |
| Mol Weight | 564.5 g/mol |
| Molecular Formula | C26H28O14 |
| Exact Mass | 564.147906 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | KGVt1aECBT |
|---|---|
| Name | Schaftoside |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C26H28O14 |
| InChI | InChI=1S/C26H28O14/c27-6-13-18(32)21(35)23(37)26(40-13)15-19(33)14-10(29)5-12(8-1-3-9(28)4-2-8)39-24(14)16(20(15)34)25-22(36)17(31)11(30)7-38-25/h1-5,11,13,17-18,21-23,25-28,30-37H,6-7H2 |
| InChIKey | MMDUKUSNQNWVET-UHFFFAOYSA-N |
| Molecular Weight | 564.496 g/mol |
| SMILES | Oc1ccc(C2=CC(c3c(c(c(c(C4C(C(C(C(O4)CO)O)O)O)c3O)O)C3C(C(O)C(CO3)O)O)O2)=O)cc1 |
| SPLASH | splash10-004j-0019240000-0d6641670a0f45e75e37 |
| Source of Spectrum | D9-19-488-1 |
| Synonyms | 5,7-Dihydroxy-2-(4-hydroxyphenyl)-6-[3,4,5-trihydroxy-6-(hydroxymethyl)-2-oxanyl]-8-(3,4,5-trihydroxy-2-oxanyl)-1-benzopyran-4-one 5,7-Dihydroxy-2-(4-hydroxyphenyl)-6-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]-8-(3,4,5-trihydroxyoxan-2-yl)chromen-4-one 5,7-Dihydroxy-2-(4-hydroxyphenyl)-6-[3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]-8-(3,4,5-trihydroxytetrahydropyran-2-yl)chromen-4-one 6-[6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl]-2-(4-hydroxyphenyl)-5,7-bis(oxidanyl)-8-[3,4,5-tris(oxidanyl)oxan-2-yl]chromen-4-one |
| Wiley ID | 1695388 |