Account Aegineoside
- Catalog No. :
- ACEJBC444
- CAS No. :
- 752209-48-6
- Molecular Formula :
- C26H30O12
- Molecular Weight :
- 534.51
IUPAC Name:(E)-3-((2R,3S)-3-(hydroxymethyl)-7-methoxy-2-(3-methoxy-4-(((2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)phenyl)-2,3-dihydrobenzofuran-5-yl)acrylic acid
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Product Information
| Product Name | Aegineoside |
|---|---|
| IUPAC Name | (E)-3-((2R,3S)-3-(hydroxymethyl)-7-methoxy-2-(3-methoxy-4-(((2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)phenyl)-2,3-dihydrobenzofuran-5-yl)acrylic acid |
| Molecular Formula | C26H30O12 |
| Molecular Weight | 534.51 |
| SMILES | O=C(O)/C=C/C1=CC(OC)=C(O[C@@H](C2=CC=C(O[C@H]3[C@@H]([C@H]([C@@H]([C@@H](CO)O3)O)O)O)C(OC)=C2)[C@@H]4CO)C4=C1 |
| InChI Key | QQYGUIBEIDPARU-IAJBZRFBSA-N |
| Synonym | 2-Propenoic acid, 3-[(2R,3S)-2-[4-(β-D-glucopyranosyloxy)-3-methoxyphenyl]-2,3-dihydro-3-(hydroxymethyl)-7-methoxy-5-benzofuranyl]-, (2E)-;Aegineoside |
| CAS No. | 752209-48-6 |
Synthetic Route by SureRoute
2. ACEJBC444 Molecular Building Block Synthetic Route
methoxyphenoxy]oxane-3,4,5-triol
Urolignoside
(2S,3R,4R,5R,6S)-2-(4-((2R,3S)-3-(hydroxymethyl)-5-(3-hydroxypropyl)-7-methoxy-2,3-dihydrobenzofuran-2-yl)-2-methoxyphenoxy)-6-methyltetrahydro-2H-pyran-3,4,5-triol