Account -
- Catalog No. :
- ACXLNR536
- CAS No. :
- 1362-42-1
- Molecular Formula :
- C30H40O6
- Molecular Weight :
- 496.64
IUPAC Name:-
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Product Information
| Product Name | - |
|---|---|
| MDL No. | MFCD00272148 |
| Molecular Formula | C30H40O6 |
| Molecular Weight | 496.64 |
| SMILES | CC1=C[C@]2([C@@]3([C@@]1([C@@]4([C@]2([C@@]5(C([C@]([H])([C@@]([H])(CC[C@]5(C)O)[C@@H]6C)OC6=O)=C4C)[H])[H])[H])[C@]([H])([C@@]([H])(CC[C@]3(C)O)[C@@H]7C)OC7=O)[H])[H] |
| InChI Key | PZHWYURJZAPXAN-ILOFNVQHSA-N |
| Synonym | Absinthin | (1R,2R,5S,8S,9S,12S,13R,14S,15S,16R,17S,20S,21S,24S)-12,17-dihydroxy-3,8,12,17,21,25-hexamethyl-6,23-dioxaheptacyclo[13.9.2.0(1,16).0(2,14).0(4,13).0(5,9).0(20,24)]hexacosa-3,25-diene-7,22-dione | ABSINTHIN [MI] | UNII-OE5992O64P | GTPL12458 | |
| CAS No. | 1362-42-1 |
| PubChem CID | 442138 |
Safety Data
- Pictogram
- Signal Word
- Warning
- Hazard Statement(s)
- H302-H315-H319-H335
- Precautionary Statement(s)
- P261-P305+P351+P338
Synthetic Route by SureRoute
2. ACXLNR536 Molecular Building Block Synthetic Route
(S)-4-((3R,3aS,3'S,3a'R,4S,6'R,7aR,8a'S,9'S,10a'S,11'S)-11'-acetoxy-4-hydroxy-3',5',6,9'-tetramethyl-2,2'-dioxo-2',3a,3',3a',4,4',6',7,7a,9',10',10a'-dodecahydro-2H,8'H-spiro[benzofuran-3,7'-[6,8a]methanobenzo[4,5]cyclohepta[1,2-b]furan]-5-yl)pentyl acetate
(4aR,5R,6R,7S,11R,12aR)-7-(((2R,3S)-3-hydroxy-2-methylbutanoyl)oxy)-9,12a,13,13-tetramethyl-4-methylene-1,2,3,4,4a,5,6,7,8,11,12,12a-dodecahydro-6,10-methanobenzo[10]annulene-3,5,11-triyl triacetate
(3S,5R)-3-((3S,5R,10S,13R,14R,17R)-3-hydroxy-4,4,10,13,14-pentamethyl-2,3,4,5,6,7,10,11,12,13,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl)-5-(3-methylbut-2-en-2-yl)dihydrofuran-2(3H)-one