| SpectraBase Compound ID | 3kspER8vbBv |
|---|---|
| InChI | InChI=1S/C21H20O10/c1-8-15(25)17(27)18(28)21(29-8)31-20-16(26)14-12(24)6-11(23)7-13(14)30-19(20)9-2-4-10(22)5-3-9/h2-8,15,17-18,21-25,27-28H,1H3/t8?,15-,17?,18-,21-/m0/s1 |
| InChIKey | SOSLMHZOJATCCP-QNGDYPQESA-N |
| Mol Weight | 432.38 g/mol |
| Molecular Formula | C21H20O10 |
| Exact Mass | 432.105647 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | DwI2ETMRqc3 |
|---|---|
| Name | Afzelin |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C21H20O10 |
| InChI | InChI=1S/C21H20O10/c1-8-15(25)17(27)18(28)21(29-8)31-20-16(26)14-12(24)6-11(23)7-13(14)30-19(20)9-2-4-10(22)5-3-9/h2-8,15,17-18,21-25,27-28H,1H3/t8?,15-,17?,18-,21-/m0/s1 |
| InChIKey | SOSLMHZOJATCCP-QNGDYPQESA-N |
| Molecular Weight | 432.381 g/mol |
| SMILES | Oc1ccc(C=2Oc3cc(cc(c3C(C2O[C@]2([C@](C([C@](C(O2)C)(O)[H])O)(O)[H])[H])=O)O)O)cc1 |
| SPLASH | splash10-000i-0090000000-35942dc1d934bd679013 |
| Source of Spectrum | QA-38-395-C |
| Synonyms | 5,7-Dihydroxy-2-(4-hydroxyphenyl)-3-[[(2S,3S,5R)-3,4,5-trihydroxy-6-methyl-2-oxanyl]oxy]-1-benzopyran-4-one 5,7-Dihydroxy-2-(4-hydroxyphenyl)-3-[(2S,3S,5R)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxychromen-4-one 5,7-Dihydroxy-2-(4-hydroxyphenyl)-3-[(2S,3S,5R)-3,4,5-trihydroxy-6-methyl-tetrahydropyran-2-yl]oxy-chromen-4-one 2-(4-hydroxyphenyl)-3-[(2S,3S,5R)-6-methyl-3,4,5-tris(oxidanyl)oxan-2-yl]oxy-5,7-bis(oxidanyl)chromen-4-one |
| Wiley ID | 861307 |