Account (1S,3R,4R,5R)-4-(((E)-3-(3,4-dihydroxyphenyl)acryloyl)oxy)-1,3-dihydroxy-5-(((E)-3-(4-hydroxy-3-methoxyphenyl)acryloyl)oxy)cyclohexane-1-carboxylic acid
- Catalog No. :
- ACHPFC799
- CAS No. :
- 96990-65-7
- Molecular Formula :
- C26H26O12
- Molecular Weight :
- 530.48
IUPAC Name:(1S,3R,4R,5R)-4-(((E)-3-(3,4-dihydroxyphenyl)acryloyl)oxy)-1,3-dihydroxy-5-(((E)-3-(4-hydroxy-3-methoxyphenyl)acryloyl)oxy)cyclohexane-1-carboxylic acid
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Product Information
| Product Name | (1S,3R,4R,5R)-4-(((E)-3-(3,4-dihydroxyphenyl)acryloyl)oxy)-1,3-dihydroxy-5-(((E)-3-(4-hydroxy-3-methoxyphenyl)acryloyl)oxy)cyclohexane-1-carboxylic acid |
|---|---|
| IUPAC Name | (1S,3R,4R,5R)-4-(((E)-3-(3,4-dihydroxyphenyl)acryloyl)oxy)-1,3-dihydroxy-5-(((E)-3-(4-hydroxy-3-methoxyphenyl)acryloyl)oxy)cyclohexane-1-carboxylic acid |
| Molecular Formula | C26H26O12 |
| Molecular Weight | 530.48 |
| SMILES | COC1=C(O)C=CC(/C=C/C(=O)O[C@@H]2C[C@](O)(C(=O)O)C[C@@H](O)[C@H]2OC(=O)/C=C/C2=CC(O)=C(O)C=C2)=C1 |
| InChI Key | SDMADMBVKYOYQN-CSPRBKSFSA-N |
| Synonym | 3-Feruloyl-4-caffeoylquinic acid;Cyclohexanecarboxylic acid, 4-[[3-(3,4-dihydroxyphenyl)-1-oxo-2-propen-1-yl]oxy]-1,3-dihydroxy-5-[[3-(4-hydroxy-3-methoxyphenyl)-1-oxo-2-propen-1-yl]oxy]-, (1S,3R,4R,5R)-;3 Feruloyl 4 caffeoylquinic acid,3Feruloyl4caffeoylquinic acid;3-Feruloyl-4-caffeoylquinic acid, 10 mM in DMSO;(1S,3R,4R,5R)-4-(((E)-3-(3,4-Dihydroxyphenyl)acryloyl)oxy)-1,3-dihydroxy-5-(((E)-3-(4-hydroxy-3-methoxyphenyl)acryloyl)oxy)cyclohexanecarboxylic acid |
| CAS No. | 96990-65-7 |
Synthetic Route by SureRoute
2. ACHPFC799 Molecular Building Block Synthetic Route
rel-(1R,3S,4S,5S)-1,3,4-Trihydroxy-5-((3-(4-hydroxy-3-methoxyphenyl)acryloyl)oxy)cyclohexane-1-carboxylic acid
(1S,3R,4R,5R)-1,3,4-trihydroxy-5-(((E)-3-(4-hydroxy-3-methoxyphenyl)acryloyl)oxy)cyclohexane-1-carboxylic acid
(1R,3R,4S,5R)-1,3,4-Trihydroxy-5-(((E)-3-(4-hydroxy-3-methoxyphenyl)acryloyl)oxy)cyclohexane-1-carboxylic acid