Account Bacoside A2
- Catalog No. :
- ACIPVW319
- CAS No. :
- 58798-95-1
- Molecular Formula :
- C46H74O17
- Molecular Weight :
- 899.08
IUPAC Name:(2S,3R,4S,5S)-2-((1R)-1-((2S,3R,4R,5S)-3,4-dihydroxy-5-(((1S,2R,4aR,6aS,6bR,8aR,10S,12aR,12bR,14aR)-1-hydroxy-1,6b,9,9,12a-pentamethyl-2-(2-methylprop-1-en-1-yl)hexadecahydro-1H,6H-4a,6a-methanonaphtho[1,2-h]pyrano[2,3-c]isochromen-10-yl)oxy)tetrahydrofuran-2-yl)-2-(((2R,3R,4R,5S)-3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl)oxy)ethoxy)tetrahydro-2H-pyran-3,4,5-triol
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Product Information
| Product Name | Bacoside A2 |
|---|---|
| IUPAC Name | (2S,3R,4S,5S)-2-((1R)-1-((2S,3R,4R,5S)-3,4-dihydroxy-5-(((1S,2R,4aR,6aS,6bR,8aR,10S,12aR,12bR,14aR)-1-hydroxy-1,6b,9,9,12a-pentamethyl-2-(2-methylprop-1-en-1-yl)hexadecahydro-1H,6H-4a,6a-methanonaphtho[1,2-h]pyrano[2,3-c]isochromen-10-yl)oxy)tetrahydrofuran-2-yl)-2-(((2R,3R,4R,5S)-3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl)oxy)ethoxy)tetrahydro-2H-pyran-3,4,5-triol |
| Molecular Formula | C46H74O17 |
| Molecular Weight | 899.08 |
| SMILES | CC(C)=C[C@@H]1CO[C@]23C[C@]4(CO2)[C@H](CC[C@@H]2[C@@]5(C)CC[C@H](O[C@H]6O[C@H]([C@@H](CO[C@@H]7O[C@@H](CO)[C@H](O)[C@H]7O)O[C@@H]7OC[C@H](O)[C@H](O)[C@H]7O)[C@H](O)[C@H]6O)C(C)(C)[C@@H]5CC[C@]24C)C3[C@@]1(C)O |
| InChI Key | MOTXTNHNHWTPDJ-FPUGBJHESA-N |
| Synonym | Bacoside A2;PubChem ID: 131855575;α-D-Glucofuranoside, (1S,2R,4aR,6aS,6bR,8aR,10S,12aR,12bR,14aR,14bS)-hexadecahydro-1-hydroxy-1,6b,9,9,12a-pentamethyl-2-(2-methyl-1-propen-1-yl)-4a,6a-methano-1H,6H-phenanthro[2,1-d]pyrano[2,3-b]pyran-10-yl O-α-L-arabinofuranosyl-(1→6)-O-[α-L-arabinopyranosyl-(1→5)]- |
| CAS No. | 58798-95-1 |
Safety Data
- Pictogram
- Signal Word
- Danger
- Hazard Statement(s)
- H301+H311+H331
- Precautionary Statement(s)
- P261-P264-P270-P271-P280-P301+P310+P330-P302+P352+P312-P304+P340+P311-P361+P364-P403+P233-P405-P501
Synthetic Route by SureRoute
2. ACIPVW319 Molecular Building Block Synthetic Route
(2S,3R,4S,5S,6R)-2-(((2R,3R,4S,5R,6R)-3,5-Dihydroxy-2-(((1S,2R,4aR,6aS,6bR,8aR,10S,12aR,12bR,14aR,14bS)-1-hydroxy-1,6b,9,9,12a-pentamethyl-2-(2-methylprop-1-en-1-yl)hexadecahydro-1H,6H-4a,6a-methanonaphtho[1,2-h]pyrano[2,3-c]isochromen-10-yl)oxy)-6-(hydroxymethyl)tetrahydro-2H-pyran-4-yl)oxy)-6-(hydroxymethyl)tetrahydro-2H-pyran-3,4,5-triol
Bacoside A1
(2S,3R,4S,5S,6R)-2-(((2S,3R,4S,5S)-3,5-Dihydroxy-2-(((1S,2R,4aR,6aS,6bR,8aR,10S,12aR,12bR,14aR,14bS)-1-hydroxy-1,6b,9,9,12a-pentamethyl-2-(2-methylprop-1-en-1-yl)octadecahydro-4a,6a-methanonaphtho[1,2-h]pyrano[2,3-c]isochromen-10-yl)oxy)tetrahydro-2H-pyra