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ChemicalBook--->CAS DataBase List--->69809-22-9

69809-22-9

69809-22-9 Structure

69809-22-9 Structure
IdentificationBack Directory
[Name]

(5S)-5,6,7,8-Tetrahydro-5α,6β,7β,8α-tetrahydroxy-2-(2-phenylethyl)-4H-1-benzopyran-4-one
[CAS]

69809-22-9
[Synonyms]

Agarotetrol
Agarotetrol(AH1)
Agarotetrol, 98%, from Aquilaria sinensis (Lour.) Spreng.
(5S)-5,6,7,8-Tetrahydro-5α,6β,7β,8α-tetrahydroxy-2-(2-phenylethyl)-4H-1-benzopyran-4-one
(5S,6R,7R,8S)-5,6,7,8-Tetrahydro-5,6,7,8-tetrahydroxy-2-(2-phenylethyl)-4H-1-benzopyran-4-one
4H-1-Benzopyran-4-one, 5,6,7,8-tetrahydro-5,6,7,8-tetrahydroxy-2-(2-phenylethyl)-, (5S,6R,7R,8S)-
[Molecular Formula]

C17H18O6
[MDL Number]

MFCD30533225
[MOL File]

69809-22-9.mol
[Molecular Weight]

318.32
Chemical PropertiesBack Directory
[Boiling point ]

581.3±50.0 °C(Predicted)
[density ]

1.48±0.1 g/cm3(Predicted)
[storage temp. ]

Store at -20°C
[solubility ]

DMF: 50 mg/ml; DMSO: 50 mg/ml; Ethanol: 10 mg/ml; PBS (pH 7.2): 10 mg/ml
[form ]

A solid
[pka]

11.75±0.70(Predicted)
[color ]

White to off-white
Safety DataBack Directory
[HS Code ]

29329990
Hazard InformationBack Directory
[Chemical Properties]

White powder, soluble in methanol, ethanol, DMSO and other organic solvents, derived from Aquilaria agallocha.
[Uses]

Agarotetrol has antibacterial, sedative and antiasthmatic effects.
[Definition]

ChEBI: Agarotetrol is a pyranone.
[in vitro]

Agarotetrol is a chromone derivative isolated from Agarwood, shows no inhibitory activity against phosphodiesterase (PDE) 3A (IC 50 , >100 μM).

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[storage]

Store at -20°C
Spectrum DetailBack Directory
[Spectrum Detail]

(5S)-5,6,7,8-Tetrahydro-5α,6β,7β,8α-tetrahydroxy-2-(2-phenylethyl)-4H-1-benzopyran-4-one(69809-22-9)1HNMR
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