Account (1S,2aR,3S,4S,5S,6S,6aS,6bS,8aS,8bR,9S,10R,11aS,12aS,12bS)-1,2a,3,4,5,6,10-heptahydroxy-6a,8a,9-trimethyl-10-(3-((((2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)methyl)but-3-en-1-yl)octadecahydro-2H-naphtho[2',1':4,5]indeno[2,1-b]furan-2-one
- Catalog No. :
- ACKNAR961
- CAS No. :
- 1013405-26-9
- Molecular Formula :
- C33H52O15
- Molecular Weight :
- 688.76
IUPAC Name:(1S,2aR,3S,4S,5S,6S,6aS,6bS,8aS,8bR,9S,10R,11aS,12aS,12bS)-1,2a,3,4,5,6,10-heptahydroxy-6a,8a,9-trimethyl-10-(3-((((2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)methyl)but-3-en-1-yl)octadecahydro-2H-naphtho[2',1':4,5]indeno[2,1-b]furan-2-one
![(1S,2aR,3S,4S,5S,6S,6aS,6bS,8aS,8bR,9S,10R,11aS,12aS,12bS)-1,2a,3,4,5,6,10-heptahydroxy-6a,8a,9-trimethyl-10-(3-((((2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)methyl)but-3-en-1-yl)octadecahydro-2H-naphtho[2',1':4,5]indeno[2,1-b]furan-2-one structure diagram](/images/productimg/no-pic.svg)
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Product Information
| Product Name | (1S,2aR,3S,4S,5S,6S,6aS,6bS,8aS,8bR,9S,10R,11aS,12aS,12bS)-1,2a,3,4,5,6,10-heptahydroxy-6a,8a,9-trimethyl-10-(3-((((2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)methyl)but-3-en-1-yl)octadecahydro-2H-naphtho[2',1':4,5]indeno[2,1-b]furan-2-one |
|---|---|
| IUPAC Name | (1S,2aR,3S,4S,5S,6S,6aS,6bS,8aS,8bR,9S,10R,11aS,12aS,12bS)-1,2a,3,4,5,6,10-heptahydroxy-6a,8a,9-trimethyl-10-(3-((((2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)methyl)but-3-en-1-yl)octadecahydro-2H-naphtho[2',1':4,5]indeno[2,1-b]furan-2-one |
| Molecular Formula | C33H52O15 |
| Molecular Weight | 688.76 |
| SMILES | C=C(CC[C@@]1(O)O[C@H]2C[C@H]3[C@@H]4[C@H](O)C(=O)[C@]5(O)[C@@H](O)[C@@H](O)[C@@H](O)[C@@H](O)[C@]5(C)[C@H]4CC[C@]3(C)[C@H]2[C@@H]1C)CO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O |
| InChI Key | WIBHYPGBYXGLMP-XYCAPGDOSA-N |
| Synonym | Furost-25-en-6-one, 27-(β-D-glucopyranosyloxy)-1,2,3,4,5,7,22-heptahydroxy-, (1β,2β,3β,4β,5β,7α,22α)-;（1β,2β,3β,4β,5β,7α,22α）-27-（β-D-Glucopyranosyloxy）-1,2,3,4,5,7,22-heptahydroxyfurost-25-en-6-one;Nitric oxide production-IN-1 |
| CAS No. | 1013405-26-9 |
Synthetic Route by SureRoute
2. ACKNAR961 Molecular Building Block Synthetic Route
Macrostemonoside I
(2aS,4S,5'R,6aR,6bS,8aS,8bR,9S,10R,11aS,12aS,12bR)-4-(((2R,3R,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-(((2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyltetrahydro-2H-pyran-2-yl)oxy)tetrahydro-2H-pyran-2-yl)oxy)-8b-hydroxy-5',6a,8a,9-tetramethylicosahydrospiro[naphtho[2',1':4,5]indeno[2,1-b]furan-10,2'-pyran]-2(1H)-one
(2S,3S,4S,5R,6R)-3,4,5-trihydroxy-6-(((3R,5R,8S,9S,10S,13S,14S,17R)-17-hydroxy-17-(2-hydroxyacetyl)-10,13-dimethyl-11-oxohexadecahydro-1H-cyclopenta[a]phenanthren-3-yl)oxy)tetrahydro-2H-pyran-2-carboxylic acid