Account (4S,4aS,5R,13bS,14aS)-5-(hydroxymethyl)-1-(methoxycarbonyl)-4-(((2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)-4a,5,7,8,13,13b,14,14a-octahydroindolo[2,3-a]pyrano[3,4-g]quinolizine 6(4H)-oxide
- Catalog No. :
- ACKFJU005
- CAS No. :
- 1092371-18-0
- Molecular Formula :
- C27H34N2O11
- Molecular Weight :
- 562.57
IUPAC Name:(4S,4aS,5R,13bS,14aS)-5-(hydroxymethyl)-1-(methoxycarbonyl)-4-(((2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)-4a,5,7,8,13,13b,14,14a-octahydroindolo[2,3-a]pyrano[3,4-g]quinolizine 6(4H)-oxide
![(4S,4aS,5R,13bS,14aS)-5-(hydroxymethyl)-1-(methoxycarbonyl)-4-(((2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)-4a,5,7,8,13,13b,14,14a-octahydroindolo[2,3-a]pyrano[3,4-g]quinolizine 6(4H)-oxide structure diagram](/images/productimg/no-pic.svg)
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Product Information
| Product Name | (4S,4aS,5R,13bS,14aS)-5-(hydroxymethyl)-1-(methoxycarbonyl)-4-(((2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)-4a,5,7,8,13,13b,14,14a-octahydroindolo[2,3-a]pyrano[3,4-g]quinolizine 6(4H)-oxide |
|---|---|
| IUPAC Name | (4S,4aS,5R,13bS,14aS)-5-(hydroxymethyl)-1-(methoxycarbonyl)-4-(((2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)-4a,5,7,8,13,13b,14,14a-octahydroindolo[2,3-a]pyrano[3,4-g]quinolizine 6(4H)-oxide |
| Molecular Formula | C27H34N2O11 |
| Molecular Weight | 562.57 |
| SMILES | COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]2[C@@H]1C[C@H]1C3=C(CC[N+]1([O-])[C@H]2CO)C1=CC=CC=C1N3 |
| InChI Key | NVUHVENKCFNJQW-GDPYHQKMSA-N |
| Synonym | 3Beta-Isodihydrocadambine 4-oxide;3β-Isodihydrocadambine 4-oxide;4H-Indolo[2,3-a]pyrano[3,4-g]quinolizine-1-carboxylic acid, 4-(β-D-glucopyranosyloxy)-4a,5,7,8,13,13b,14,14a-octahydro-5-(hydroxymethyl)-, methyl ester, 6-oxide, (4S,4aS,5R,13bR,14aS)- |
| CAS No. | 1092371-18-0 |
Synthetic Route by SureRoute
2. ACKFJU005 Molecular Building Block Synthetic Route
methyl 5-(hydroxymethyl)-4-((3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)-4a,5,7,8,13,13b,14,14a-octahydro-4H-indolo[2,3-a]pyrano[3,4-g]quinolizine-1-carboxylate
methyl (4S,4aS,5S,14bS,15aS)-5-hydroxy-4-(((2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)-4,4a,5,6,8,9,14,14b,15,15a-decahydropyrano[4'',3'':4',5']azepino[1',2':1,2]pyrido[3,4-b]indole-1-carboxylate
Mappianine C