ChemicalBook--->CAS DataBase List--->1362-42-1

1362-42-1

1362-42-1 Structure

1362-42-1 Structure
IdentificationBack Directory
[Name]

ABSINTHIN
[CAS]

1362-42-1
[Synonyms]

ABSINTHIN
ABSYNTHIN
Sbsinthin
Absynthine
Absinthiin
ABSINTHII TINCTURA
ABSINTHIN USP/EP/BP
2H-7,13b-Ethenopentaleno[1'',2'':6,7
Absinthin, 95%, from Artemisia absinthium L.
5'',4'':6',7']dicyclohepta[1,2-b:1',2'-b']difuran-2,12(11H)-dione,3,3a,4,5,6,6a,6b,7,7a,8,9,10,10a,13a,13c,14b-hexadecahydro-6,8-dihydroxy-3,6,8,11,14,15-hexamethyl-,(3S,3aS,6S,6aR,6bS,7S,7aR,8S,10aS,11S,13aS,13bR,13cR
5'',4'':6',7']dicyclohepta[1,2-b:1',2'-b']difuran-2,12(11H)-dione, 3,3a,4,5,6,6a,6b,7,7a,8,9,10,10a,13a,13c,14b-hexadecahydro-6,8-dihydroxy-3,6,8,11,14,15-hexamethyl-, (3S,3aS,6S,6aR,6bS,7S,7aR,8S,10aS,11S,13aS,13bR,13cR,14bS)-
[Molecular Formula]

C30H40O6
[MDL Number]

MFCD00272148
[MOL File]

1362-42-1.mol
[Molecular Weight]

496.64
Chemical PropertiesBack Directory
[Melting point ]

165-166℃ (dec.)
[alpha ]

D20 +107.0° (c = 1.9 in CHCl3); D20 +103.5° (c = 1.0 in CHCl3)
[Boiling point ]

700.6±60.0 °C(Predicted)
[density ]

1.29±0.1 g/cm3 (20 ºC 760 Torr)
[storage temp. ]

Amber Vial, -20°C Freezer, Under inert atmosphere
[solubility ]

Chloroform (Slightly, Sonicated), DMSO (Slightly), Methanol (Slightly)
[form ]

Solid
[pka]

14.66±0.70(Predicted)
[color ]

White to Off-White
[Water Solubility ]

insoluble in water
[Stability:]

Light Sensitive, Unstable in Acidic Condition
[InChIKey]

PZHWYURJZAPXAN-ILOFNVQHSA-N
[SMILES]

O1[C@@H]2[C@@]43[C@@H]([C@@H]([C@H]5[C@@H]4C(=C6[C@H]7OC(=O)[C@H]([C@@H]7CC[C@@]([C@@H]65)(O)C)C)C)C=C3C)[C@](CC[C@H]2[C@@H](C1=O)C)(O)C
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H302-H315-H319-H335
[Precautionary statements ]

P261-P305+P351+P338
[WGK Germany ]

WGK 3
[HS Code ]

29329990
[Storage Class]

11 - Combustible Solids
Hazard InformationBack Directory
[Uses]

Absinthin is an extract from the bitter liquor Absinthe, which owes its taste to substances found in the wormwood plant used in its formulation. Absinthin contributes to this bitter taste through action upon the hTAS2R14 bitter taste receptor.
[Definition]

ChEBI: A dimeric sesquiterpene lactone that is produced by the plant Artemisia absinthium (Wormwood). The bitter tasting constituent of Absinthe.
[in vivo]

Absinthin (20-80mg/kg, p.o.) relieves LPS-induced acute lung injury (reduces inflammatory cell infiltration and improves lung architecture) in mice[4].

Animal Model:LPS-induced acute lung injury in mice[4]
Dosage:20, 40, 80mg/kg
Administration:p.o.
Result:Reduced inflammatory cell infiltration and improved lung architecture.
Reduced MPO activity, infiltration of neutrophils, lung tissue wet-to-dry ratio.
Reduced the secretion of proinflammatory cytokines and chemokines (TNF-α, IL-1β, IL-6 , and MIP-1α).
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