| SpectraBase Compound ID | 1tihyskciH8 |
|---|---|
| InChI | InChI=1S/C26H28O14/c27-6-13-18(32)21(35)23(37)26(40-13)16-20(34)15(25-22(36)17(31)11(30)7-38-25)19(33)14-10(29)5-12(39-24(14)16)8-1-3-9(28)4-2-8/h1-5,11,13,17-18,21-23,25-28,30-37H,6-7H2 |
| InChIKey | OVMFOVNOXASTPA-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 | 2LirZffMK7P |
|---|---|
| Name | Isoschaftoside |
| 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)16-20(34)15(25-22(36)17(31)11(30)7-38-25)19(33)14-10(29)5-12(39-24(14)16)8-1-3-9(28)4-2-8/h1-5,11,13,17-18,21-23,25-28,30-37H,6-7H2 |
| InChIKey | OVMFOVNOXASTPA-UHFFFAOYSA-N |
| Molecular Weight | 564.496 g/mol |
| SMILES | Oc1ccc(C2=CC(c3c(c(C4C(C(C(C(O4)CO)O)O)O)c(c(c3O)C3C(C(O)C(CO3)O)O)O)O2)=O)cc1 |
| SPLASH | splash10-004i-0029330000-852cae1246dde6f95d74 |
| Source of Spectrum | D9-19-488-2 |
| Synonyms | 5,7-Dihydroxy-2-(4-hydroxyphenyl)-8-[3,4,5-trihydroxy-6-(hydroxymethyl)-2-oxanyl]-6-(3,4,5-trihydroxy-2-oxanyl)-1-benzopyran-4-one 5,7-Dihydroxy-2-(4-hydroxyphenyl)-8-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]-6-(3,4,5-trihydroxyoxan-2-yl)chromen-4-one 5,7-Dihydroxy-2-(4-hydroxyphenyl)-8-[3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]-6-(3,4,5-trihydroxytetrahydropyran-2-yl)chromen-4-one 8-[6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl]-2-(4-hydroxyphenyl)-5,7-bis(oxidanyl)-6-[3,4,5-tris(oxidanyl)oxan-2-yl]chromen-4-one |
| Wiley ID | 1695387 |