Iridin
5-hydroxy-3-(3-hydroxy-4,5-dimethoxyphenyl)-6-methoxy-7-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one
Also Known As: Iridin|Buddleoside|Irisin|Lridin|Irigenin 7-glucoside|Iridin (Standard)|Spectrum_000619|Irigenin 7-O-glucoside|SpecPlus_000143|Spectrum2_000198|Spectrum3_000192|Spectrum4_001510|Spectrum5_000279|BSPBio_001743|KBioGR_002179|KBioSS_001099|SPECTRUM200793|DivK1c_006239|SPBio_000155|IRIDIN (REFERENCE GRADE)|ERK5-5A21|HY-N3011R|KBio1_001183|KBio2_001099|KBio2_003667|KBio2_006235|KBio3_001243|KS-00000TYO|WLZ4673|HY-N3011|irigenin 7-O-beta-D-glucopyranoside|9568AF
| Molecular Formula | C24H26O13 |
|---|---|
| Molecular Weight | 522.1373 g/mol |
| LogP | 0.0757 |
| Topological Polar Surface Area | 197.74 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 13 |
| Rotatable Bonds | 7 |
| Exact Mass | 522.1373 |
| Monoisotopic Mass | 522.1373 |
| Heavy Atoms | 37 |
| Complexity | 1348.9482 |
Chemical Identifiers
| CAS Number | 491-74-7 |
|---|---|
| SMILES | COC1=CC(=CC(=C1OC)O)C2=COC3=CC(=C(C(=C3C2=O)O)OC)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O |
Product Overview
Iridin (CAS 491-74-7), with molecular formula C24H26O13 and molecular weight 522.1373 g/mol. IUPAC: 5-hydroxy-3-(3-hydroxy-4,5-dimethoxyphenyl)-6-methoxy-7-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one.
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