Account (3S,4R,5R,6S)-4,5-dihydroxy-2-(4-(5-hydroxy-7-methoxy-4-oxo-3-(((3S,4R,5R,6S)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)-4H-chromen-2-yl)phenoxy)-6-(hydroxymethyl)tetrahydro-2H-pyran-3-yl (2E,4E)-5-((1R,3S,5S,8R)-3,8-dihydroxy-1,5-dimethyl-6-oxabicyclo[3.2.1]octan-8-yl)-3-methylpenta-2,4-dienoate
- Catalog No. :
- ACFCCY099
- CAS No. :
- 138505-45-0
- Molecular Formula :
- C43H52O20
- Molecular Weight :
- 888.87
IUPAC Name:(3S,4R,5R,6S)-4,5-dihydroxy-2-(4-(5-hydroxy-7-methoxy-4-oxo-3-(((3S,4R,5R,6S)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)-4H-chromen-2-yl)phenoxy)-6-(hydroxymethyl)tetrahydro-2H-pyran-3-yl (2E,4E)-5-((1R,3S,5S,8R)-3,8-dihydroxy-1,5-dimethyl-6-oxabicyclo[3.2.1]octan-8-yl)-3-methylpenta-2,4-dienoate
![(3S,4R,5R,6S)-4,5-dihydroxy-2-(4-(5-hydroxy-7-methoxy-4-oxo-3-(((3S,4R,5R,6S)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)-4H-chromen-2-yl)phenoxy)-6-(hydroxymethyl)tetrahydro-2H-pyran-3-yl (2E,4E)-5-((1R,3S,5S,8R)-3,8-dihydroxy-1,5-dimethyl-6-oxabicyclo[3.2.1]octan-8-yl)-3-methylpenta-2,4-dienoate structure diagram](/images/productimg/no-pic.svg)
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Product Information
| Product Name | (3S,4R,5R,6S)-4,5-dihydroxy-2-(4-(5-hydroxy-7-methoxy-4-oxo-3-(((3S,4R,5R,6S)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)-4H-chromen-2-yl)phenoxy)-6-(hydroxymethyl)tetrahydro-2H-pyran-3-yl (2E,4E)-5-((1R,3S,5S,8R)-3,8-dihydroxy-1,5-dimethyl-6-oxabicyclo[3.2.1]octan-8-yl)-3-methylpenta-2,4-dienoate |
|---|---|
| IUPAC Name | (3S,4R,5R,6S)-4,5-dihydroxy-2-(4-(5-hydroxy-7-methoxy-4-oxo-3-(((3S,4R,5R,6S)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)-4H-chromen-2-yl)phenoxy)-6-(hydroxymethyl)tetrahydro-2H-pyran-3-yl (2E,4E)-5-((1R,3S,5S,8R)-3,8-dihydroxy-1,5-dimethyl-6-oxabicyclo[3.2.1]octan-8-yl)-3-methylpenta-2,4-dienoate |
| Molecular Formula | C43H52O20 |
| Molecular Weight | 888.87 |
| SMILES | COC1=CC(O)=C2C(=O)C(OC3O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]3O)=C(C3=CC=C(OC4O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]4OC(=O)/C=C(C)/C=C/[C@@]4(O)[C@@]5(C)CO[C@@]4(C)C[C@@H](O)C5)C=C3)OC2=C1 |
| InChI Key | PUGHVEFZEJLZSW-LTXLENDNSA-N |
| Synonym | 4H-1-Benzopyran-4-one, 2-[4-[[2-O-[5-(3,8-dihydroxy-1,5-dimethyl-6-oxabicyclo[3.2.1]oct-8-yl)-3-methyl-1-oxo-2,4-pentadienyl]-β-D-glucopyranosyl]oxy]phenyl]-3-(β-D-glucopyranosyloxy)-5-hydroxy-7-methoxy-, [1R-[1α,3α,5α,8S*(2Z,4E)]]- (9CI);Complanatin I |
| CAS No. | 138505-45-0 |
Synthetic Route by SureRoute
2. ACFCCY099 Molecular Building Block Synthetic Route
Complanatin
((3S,4R,5S)-5-(((2S,3R,4S,5S,6R)-4,5-Dihydroxy-2-((5-hydroxy-2-(4-hydroxyphenyl)-7-methoxy-4-oxo-4H-chromen-3-yl)oxy)-6-(hydroxymethyl)tetrahydro-2H-pyran-3-yl)oxy)-3,4-dihydroxytetrahydrofuran-3-yl)methyl (E)-3-(4-hydroxy-3-methoxyphenyl)acrylate
((3S,4R,5S)-5-(((2S,3R,4S,5S,6R)-4,5-dihydroxy-2-((5-hydroxy-7-methoxy-4-oxo-2-(4-(((2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)phenyl)-4H-chromen-3-yl)oxy)-6-(hydroxymethyl)tetrahydro-2H-pyran-3-yl)oxy)-3,4-dihydroxytetrahydrofuran-3-yl)methyl (E)-3-(4-hydroxy-3-methoxyphenyl)acrylate