Account (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
- Catalog No. :
- ACAAYE767
- CAS No. :
- 1215276-36-0
- Molecular Formula :
- C27H30O15
- Molecular Weight :
- 594.52
IUPAC Name:(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
![(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 structure diagram](/images/productimg/no-pic.svg)
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Product Information
| Product Name | (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 |
|---|---|
| IUPAC Name | (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 |
| Molecular Formula | C27H30O15 |
| Molecular Weight | 594.52 |
| SMILES | O=C1C2=C(O[C@]3(C2)OC[C@@H](O)[C@@H](O)[C@@H]3O)[C@@](O)([C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)C(=O)/C1=C(O)\C=C\C1=CC=C(O)C=C1 |
| InChI Key | AVPPNNSAJQMDDN-AXEVCMOISA-N |
| Synonym | Spiro[benzofuran-2(3H),2'-[2H]pyran]-4,6(5H,7H)-dione, 7-β-D-glucopyranosyl-3',4',5',6'-tetrahydro-3',4',5',7-tetrahydroxy-5-[(2E)-1-hydroxy-3-(4-hydroxyphenyl)-2-propen-1-ylidene]-, (2S,3'S,4'R,5E,5'R,7S)-;Saffloquinoside A |
| CAS No. | 1215276-36-0 |
Synthetic Route by SureRoute
2. ACAAYE767 Molecular Building Block Synthetic Route
(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
(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
Safflor yellow A