Account (2S,3R,3aS)-5-Allyl-2-(3,4-dimethoxyphenyl)-3a-methoxy-3-methyl-3,3a-dihydrobenzofuran-6(2H)-one
- Catalog No. :
- ACSUEM505
- CAS No. :
- 95851-37-9
- Molecular Formula :
- C21H24O5
- Molecular Weight :
- 356.42
IUPAC Name:(2S,3R,3aS)-5-allyl-2-(3,4-dimethoxyphenyl)-3a-methoxy-3-methyl-3,3a-dihydrobenzofuran-6(2H)-one
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Product Information
| Product Name | (2S,3R,3aS)-5-Allyl-2-(3,4-dimethoxyphenyl)-3a-methoxy-3-methyl-3,3a-dihydrobenzofuran-6(2H)-one |
|---|---|
| IUPAC Name | (2S,3R,3aS)-5-allyl-2-(3,4-dimethoxyphenyl)-3a-methoxy-3-methyl-3,3a-dihydrobenzofuran-6(2H)-one |
| Molecular Formula | C21H24O5 |
| Molecular Weight | 356.42 |
| SMILES | O=C1C(CC=C)=C[C@]2(OC)[C@H](C)[C@@H](C3=CC=C(OC)C(OC)=C3)OC2=C1 |
| InChI Key | VDYACOATPFOZIO-UBWHGVKJSA-N |
| Synonym | Kadsurenone, (+)- | CS-0633861 | (2S,3R,3aS)-2-(3,4-Dimethoxyphenyl)-3,3a-dihydro-3a-methoxy-3-methyl-5-(2-propen-1-yl)-6(2H)-benzofuranone | (2S,3R,3aS)-5-allyl-2-(3,4-dimethoxyphenyl)-3a-methoxy-3-methyl-2,3-dihydrobenzofuran-6-one | Kadsurenone A | BDB |
| CAS No. | 95851-37-9 |
| PubChem CID | 122159 |
Safety Data
- Pictogram
- Signal Word
- Warning
- Hazard Statement(s)
- H302
- 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. ACSUEM505 Molecular Building Block Synthetic Route
(±)-7-epi-Kadsurenone
(2S,3R,3aR)-5-allyl-2-(3,4-dimethoxyphenyl)-3a-methoxy-3-methyl-3,3a-dihydrobenzofuran-6(2H)-one
5-allyl-3a-methoxy-3-methyl-2-(3,4,5-trimethoxyphenyl)-3,3a-dihydrobenzofuran-6(2H)-one