| Identification | Back Directory | [Name]
ANISATIN | [CAS]
5230-87-5 | [Synonyms]
ANISATIN
ANISATIN(RG)
Fruit of illicium anisatum L.
(1R,6S)-4,5,6a,7,8,9-Hexahydro-1,5α,6aα,7α-tetrahydroxy-5,9β-dimethylspiro[6H-4α,9aα-methanocyclopenta[d]oxocin-6,3'-oxetane]-2,2'(1H)-dione
(1R,6S)-4,5,6a,7,8,9,9a-Heptahydro-1,5α,6aα,7α-tetrahydroxy-5,9β-dimethylspiro[6H-4α,9aα-methanocyclopenta[d]oxocin-6,3'-oxetane]-2,2'(1H)-dione
Spiro[4H-4,9a-methanocyclopent[d]oxocin-6(2H),3'-oxetane]-2,2'-dione, hexahydro-1,5,6a,7-tetrahydroxy-5,9-dimethyl-, (1R,3'S,4R,5R,6aR,7R,9R,9aS)- | [Molecular Formula]
C15H20O8 | [MDL Number]
MFCD01683844 | [MOL File]
5230-87-5.mol | [Molecular Weight]
328.31 |
| Chemical Properties | Back Directory | [Melting point ]
227-228℃ | [Boiling point ]
609.5±55.0 °C(Predicted) | [density ]
1.63±0.1 g/cm3 (20 ºC 760 Torr) | [storage temp. ]
?20°C | [form ]
neat | [pka]
12.01±0.70(Predicted) | [color ]
White to off-white | [LogP]
-0.930 (est) |
| Hazard Information | Back Directory | [Hazard]
Moderately toxic by ingestion.
| [Uses]
food and beverages | [Safety Profile]
A poison by intraperitoneal route.Moderately toxic by ingestion. When heated todecomposition it emits acrid smoke and irritating vapors. | [in vivo]
In mice, the LD50 reported for anisatin ranges from 0.76 to 1?mg/kg (po and ip)[1]. |
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