Account rel-(1R,3S,4S,5S)-1,3,4-Trihydroxy-5-((3-(4-hydroxy-3-methoxyphenyl)acryloyl)oxy)cyclohexane-1-carboxylic acid
- Catalog No. :
- ACJBVD042
- CAS No. :
- 1899-29-2
- Molecular Formula :
- C17H20O9
- Molecular Weight :
- 368.34
IUPAC Name:(1R,3S,4S,5S)-1,3,4-trihydroxy-5-(((E)-3-(4-hydroxy-3-methoxyphenyl)acryloyl)oxy)cyclohexane-1-carboxylic acid
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Product Information
| Product Name | rel-(1R,3S,4S,5S)-1,3,4-Trihydroxy-5-((3-(4-hydroxy-3-methoxyphenyl)acryloyl)oxy)cyclohexane-1-carboxylic acid |
|---|---|
| IUPAC Name | (1R,3S,4S,5S)-1,3,4-trihydroxy-5-(((E)-3-(4-hydroxy-3-methoxyphenyl)acryloyl)oxy)cyclohexane-1-carboxylic acid |
| Molecular Formula | C17H20O9 |
| Molecular Weight | 368.34 |
| SMILES | COC1=C(O)C=CC(/C=C/C(O[C@H]2C[C@](O)(C[C@H](O)[C@@H]2O)C(O)=O)=O)=C1 |
| InChI Key | RAGZUCNPTLULOL-LWOZFZEPSA-N |
| Synonym | 3-O-Feruloylquinic acid;5-Feruoylquinic acid;(1S,3S,4S,5S)-1,3,4-trihydroxy-5-{[(2E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyl]oxy}cyclohexanecarboxylic acid;Cyclohexanecarboxylic acid, 1,3,4-trihydroxy-5-[[3-(4-hydroxy-3-methoxyphenyl)-1-oxo-2-propen-1-yl]oxy]-, (1R,3S,4S,5S)-rel-;Feruloylquinic Acid;3-Feruloylquinic acid;3Feruloylquinic acid,3 Feruloylquinic acid;rel-(1R,3S,4S,5S)-1,3,4-Trihydroxy-5-((3-(4-hydroxy-3-methoxyphenyl)acryloyl)oxy)cyclohexane-1-carboxylic acid |
| CAS No. | 1899-29-2 |
Safety Data
- Pictogram
- Signal Word
- Warning
- Hazard Statement(s)
- H302-H315-H319
- Precautionary Statement(s)
- P264-P270-P280-P301+P312+P330-P302+P352-P305+P351+P338-P332+P313-P337+P313-P362+P364-P501
Synthetic Route by SureRoute
2. ACJBVD042 Molecular Building Block Synthetic Route
(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
(1R,3R,4S,5R)-1,3,4-Trihydroxy-5-(((E)-3-(4-hydroxy-3-methoxyphenyl)acryloyl)oxy)cyclohexane-1-carboxylic acid