Account (2R,3R,4S,5S,6R)-2-(((3S,6aR,11aS,11bR)-9-((S)-1-((2S,3R,5S)-3-Hydroxy-5-methylpiperidin-2-yl)ethyl)-10,11b-dimethyl-2,3,4,6,6a,11,11a,11b-octahydro-1H-benzo[a]fluoren-3-yl)oxy)-6-(hydroxymethyl)tetrahydro-2H-pyran-3,4,5-triol
- Catalog No. :
- ACUENE186
- CAS No. :
- 475-00-3
- Molecular Formula :
- C33H49NO7
- Molecular Weight :
- 571.76
IUPAC Name:(2R,3R,4S,5S,6R)-2-(((3S,6aR,11aS,11bR)-9-((S)-1-((2S,3R,5S)-3-hydroxy-5-methylpiperidin-2-yl)ethyl)-10,11b-dimethyl-2,3,4,6,6a,11,11a,11b-octahydro-1H-benzo[a]fluoren-3-yl)oxy)-6-(hydroxymethyl)tetrahydro-2H-pyran-3,4,5-triol
![(2R,3R,4S,5S,6R)-2-(((3S,6aR,11aS,11bR)-9-((S)-1-((2S,3R,5S)-3-Hydroxy-5-methylpiperidin-2-yl)ethyl)-10,11b-dimethyl-2,3,4,6,6a,11,11a,11b-octahydro-1H-benzo[a]fluoren-3-yl)oxy)-6-(hydroxymethyl)tetrahydro-2H-pyran-3,4,5-triol structure diagram](/images/productimg/no-pic.svg)
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Product Information
| Product Name | (2R,3R,4S,5S,6R)-2-(((3S,6aR,11aS,11bR)-9-((S)-1-((2S,3R,5S)-3-Hydroxy-5-methylpiperidin-2-yl)ethyl)-10,11b-dimethyl-2,3,4,6,6a,11,11a,11b-octahydro-1H-benzo[a]fluoren-3-yl)oxy)-6-(hydroxymethyl)tetrahydro-2H-pyran-3,4,5-triol |
|---|---|
| IUPAC Name | (2R,3R,4S,5S,6R)-2-(((3S,6aR,11aS,11bR)-9-((S)-1-((2S,3R,5S)-3-hydroxy-5-methylpiperidin-2-yl)ethyl)-10,11b-dimethyl-2,3,4,6,6a,11,11a,11b-octahydro-1H-benzo[a]fluoren-3-yl)oxy)-6-(hydroxymethyl)tetrahydro-2H-pyran-3,4,5-triol |
| MDL No. | MFCD01675321 |
| Molecular Formula | C33H49NO7 |
| Molecular Weight | 571.76 |
| SMILES | CC1=C([C@H](C)[C@@H]2NC[C@@H](C)C[C@H]2O)C=CC2=C1C[C@H]1[C@H]2CC=C2C[C@@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)CC[C@@]21C |
| InChI Key | WXQHVBNTINGJJR-NIFRNHPISA-N |
| Synonym | VERATROSINE;14,15,16,17-Tetradehydro-23β-hydroxyveratraman-3β-yl β-D-glucopyranoside;3-O-beta-D-Glucopyranosylveratramine;Veratramine 3-glucoside;Veratramine 3-O-glucoside;β-D-Glucopyranoside, (3β,23β)-14,15,16,17-tetradehydro-23-hydroxyveratraman-3-yl;(2R,3R,4S,5S,6R)-2-(((3S,6aR,11aS,11bR)-9-((S)-1-((2S,3R,5S)-3-Hydroxy-5-methylpiperidin-2-yl)ethyl)-10,11b-dimethyl-2,3,4,6,6a,11,11a,11b-octahydro-1H-benzo[a]fluoren-3-yl)oxy)-6-(hydroxymethyl)tetrahydro-2H-pyran-3,4,5-triol |
| CAS No. | 475-00-3 |
| PubChem CID | 23616879 |
Synthetic Route by SureRoute
2. ACUENE186 Molecular Building Block Synthetic Route
(2S,3R,5S)-2-((S)-1-((3S,6aR,11aS,11bR)-3-Hydroxy-10,11b-dimethyl-2,3,4,6,6a,11,11a,11b-octahydro-1H-benzo[a]fluoren-9-yl)ethyl)-5-methylpiperidin-3-ol
3-hydroxy-4-methoxy-1,2,3,4,5,6-hexahydro-4a,11b-(epiminoethano)-4,6-epoxyphenanthro[2,3-d][1,3]dioxol-2-yl 4-hydroxy-3-methoxybenzoate