Ononin
3-(4-methoxyphenyl)-7-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one
Also Known As: Ononin|Formononetin glucoside|Ononoside|Fomononetin|Onoside|Formononetin 7-O-glucoside|Ononin (Standard)|formononetin-7-O-glucoside|Formononetin 7-glucoside|ONONIN [USP-RS]|ONONIN [MI]|Fomononetin-7-O-glucoside|Glucosyl-7-O-Formononetin|formononetin-7-O-glycoside|Formononetin-7-O-beta-D-glucopyranoside|MEGxp0_000395|formononetin 7-O-beta-glucoside|Calycosin-7-O-beta-D-glucoside|ONONIN (REFERENCE GRADE)|ACon1_000463|HY-N0270R|Formononetin 7-O-beta-D-glucopyranoside|formononetin-7-o-beta-d-glucoside|formononetin 7-O-beta-D-glycoside|formononetin-7-O-beta-D-glycoside|Ononin, >=99.0% (TLC)|4'-Methoxyisoflavone-7-O-beta-D-glucopyranoside|HY-N0270|NP2529
| Molecular Formula | C22H22O9 |
|---|---|
| Molecular Weight | 430.12637 g/mol |
| LogP | 1.0 |
| Topological Polar Surface Area | 135.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 5 |
| Exact Mass | 430.12637 |
| Monoisotopic Mass | 430.12637 |
| Heavy Atoms | 31 |
| Complexity | 659.0 |
Chemical Identifiers
| CAS Number | 486-62-4 |
|---|---|
| SMILES | COC1=CC=C(C=C1)C2=COC3=C(C2=O)C=CC(=C3)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O |
| InChIKey | MGJLSBDCWOSMHL-MIUGBVLSSA-N |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Ononin (CAS 486-62-4), with molecular formula C22H22O9 and molecular weight 430.12637 g/mol. IUPAC: 3-(4-methoxyphenyl)-7-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one.