Account (E)-4-((2S,3R)-4,7-dihydroxy-5-((E)-3-(4-hydroxyphenyl)acryloyl)-6-oxo-2-((1S,2R,3R)-1,2,3,4-tetrahydroxybutyl)-7-((2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)-2,3,6,7-tetrahydrobenzofuran-3-yl)-2,5-dihydroxy-6-((E)-1-hydroxy-3-(4-hydroxyphenyl)allylidene)-2-((2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)cyclohex-4-ene-1,3-dione
- Catalog No. :
- ACXITF333
- CAS No. :
- 184840-84-4
- Molecular Formula :
- C48H52O26
- Molecular Weight :
- 1044.92
IUPAC Name:(E)-4-((2S,3R)-4,7-dihydroxy-5-((E)-3-(4-hydroxyphenyl)acryloyl)-6-oxo-2-((1S,2R,3R)-1,2,3,4-tetrahydroxybutyl)-7-((2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)-2,3,6,7-tetrahydrobenzofuran-3-yl)-2,5-dihydroxy-6-((E)-1-hydroxy-3-(4-hydroxyphenyl)allylidene)-2-((2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)cyclohex-4-ene-1,3-dione
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Product Information
| Product Name | (E)-4-((2S,3R)-4,7-dihydroxy-5-((E)-3-(4-hydroxyphenyl)acryloyl)-6-oxo-2-((1S,2R,3R)-1,2,3,4-tetrahydroxybutyl)-7-((2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)-2,3,6,7-tetrahydrobenzofuran-3-yl)-2,5-dihydroxy-6-((E)-1-hydroxy-3-(4-hydroxyphenyl)allylidene)-2-((2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)cyclohex-4-ene-1,3-dione |
|---|---|
| IUPAC Name | (E)-4-((2S,3R)-4,7-dihydroxy-5-((E)-3-(4-hydroxyphenyl)acryloyl)-6-oxo-2-((1S,2R,3R)-1,2,3,4-tetrahydroxybutyl)-7-((2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)-2,3,6,7-tetrahydrobenzofuran-3-yl)-2,5-dihydroxy-6-((E)-1-hydroxy-3-(4-hydroxyphenyl)allylidene)-2-((2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)cyclohex-4-ene-1,3-dione |
| MDL No. | MFCD32644781 |
| Molecular Formula | C48H52O26 |
| Molecular Weight | 1044.92 |
| SMILES | O=C(/C=C/C1=CC=C(O)C=C1)C1=C(O)C2=C(O[C@H]([C@@H](O)[C@H](O)[C@H](O)CO)[C@H]2C2=C(O)/C(=C(O)/C=C/C3=CC=C(O)C=C3)C(=O)C(O)([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)C2=O)C(O)([C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)C1=O |
| InChI Key | NOXZTJVQKYBYAV-ARYFSBDYSA-N |
| Synonym | Anhydrosafflor yellow B;4(2H)-Benzofuranone, 7-β-D-glucopyranosyl-3-[3-β-D-glucopyranosyl-2,3,4-trihydroxy-5-[(2E)-3-(4-hydroxyphenyl)-1-oxo-2-propenyl]-6-oxo-1,4-cyclohexadien-1-yl]-3,7-dihydro-6,7-dihydroxy-5-[(2E)-3-(4-hydroxyphenyl)-1-oxo-2-propenyl]-2-[(1S,2R,3R)-1,2,3,4-tetrahydroxybutyl]-, (2S,3S)-;(2S,3S)-6,7-dihydroxy-5-[(2E)-3-(4-hydroxyphenyl)prop-2-enoyl]-2-[(1S,2R,3R)-1,2,3,4-tetrahydroxybutyl]-3-{2,3,4-trihydroxy-5-[(2E)-3-(4-hydroxyphenyl)prop-2-enoyl]-6-oxo-3-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]cyclohexa-1,4-dien-1;AHSYB |
| CAS No. | 184840-84-4 |
| PubChem CID | 145708070 |
Synthetic Route by SureRoute
2. ACXITF333 Molecular Building Block Synthetic Route
(S,Z)-5,6-Dihydroxy-4-((E)-3-(4-hydroxyphenyl)acryloyl)-2-(((S)-2,3,4-trihydroxy-5-((E)-3-(4-hydroxyphenyl)acryloyl)-6-oxo-3-((2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)cyclohexa-1,4-dien-1-yl)methylene)-6-((2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)cyclohex-4-ene-1,3-dione
(Z)-2,5-dihydroxy-6-((E)-1-hydroxy-3-(4-hydroxyphenyl)allylidene)-2,4-bis(3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)cyclohex-4-ene-1,3-dione
(2S,3'S,4'R,5'R,7S,E)-3',4',5',7-Tetrahydroxy-5-((E)-1-hydroxy-3-(4-hydroxyphenyl)allylidene)-7-((2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)-3,3',4',5',6',7-hexahydro-4H-spiro[benzofuran-2,2'-pyran]-4,6(5H)-dione