Account 7-(((2S,3R,4R,5S,6S)-3,5-Dihydroxy-6-(hydroxymethyl)-4-(((2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-methyltetrahydro-2H-pyran-2-yl)oxy)tetrahydro-2H-pyran-2-yl)oxy)-3,5,8-trihydroxy-2-(4-hydroxyphenyl)-4H-chromen-4-one
- Catalog No. :
- ACGIJY459
- CAS No. :
- 86831-54-1
- Molecular Formula :
- C27H30O16
- Molecular Weight :
- 610.52
IUPAC Name:7-(((2S,3R,4R,5S,6S)-3,5-dihydroxy-6-(hydroxymethyl)-4-(((2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-methyltetrahydro-2H-pyran-2-yl)oxy)tetrahydro-2H-pyran-2-yl)oxy)-3,5,8-trihydroxy-2-(4-hydroxyphenyl)-4H-chromen-4-one
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Product Information
| Product Name | 7-(((2S,3R,4R,5S,6S)-3,5-Dihydroxy-6-(hydroxymethyl)-4-(((2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-methyltetrahydro-2H-pyran-2-yl)oxy)tetrahydro-2H-pyran-2-yl)oxy)-3,5,8-trihydroxy-2-(4-hydroxyphenyl)-4H-chromen-4-one |
|---|---|
| IUPAC Name | 7-(((2S,3R,4R,5S,6S)-3,5-dihydroxy-6-(hydroxymethyl)-4-(((2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-methyltetrahydro-2H-pyran-2-yl)oxy)tetrahydro-2H-pyran-2-yl)oxy)-3,5,8-trihydroxy-2-(4-hydroxyphenyl)-4H-chromen-4-one |
| MDL No. | - |
| Molecular Formula | C27H30O16 |
| Molecular Weight | 610.52 |
| SMILES | O=C1C(O)=C(C2=CC=C(O)C=C2)OC3=C1C(O)=CC(O[C@H]4[C@H](O)[C@H](O[C@H]5[C@H](O)[C@@H](O)[C@H](O)[C@@H](C)O5)[C@@H](O)[C@H](CO)O4)=C3O |
| InChI Key | KZNPPMZPUGTWNT-IPZYUZOHSA-N |
| Synonym | herbacetin 7-O-(3''-O-beta-D-glucopyranosyl-alpha-L-rhamnopyranoside) | DTXSID801318608 | Rhodiosin | MFCD00238673 | CS-0022638 | Rhodiosin; Herbacetin-7-O-glucorhamnoside | 4H-1-BENZOPYRAN-4-ONE, 7-((6-DEOXY-3-O-.BETA.-D-GLUCOPYRANOSYL-.ALPHA.-L-MANNOPYR |
| CAS No. | 86831-54-1 |
| PubChem CID | 76959646 |
Safety Data
- Pictogram
- Signal Word
- Warning
- Hazard Statement(s)
- H302-H315-H319-H335
- Precautionary Statement(s)
- P261-P305+P351+P338
Synthetic Route by SureRoute
2. ACGIJY459 Molecular Building Block Synthetic Route
3,5,8-Trihydroxy-2-(4-hydroxyphenyl)-7-(((2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyltetrahydro-2H-pyran-2-yl)oxy)-4H-chromen-4-one
2-(3,4-Dihydroxyphenyl)-3,5,8-trihydroxy-7-(((2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)-4H-chromen-4-one
6-Hydroxykaempferol 7-O-β-glucopyranoside