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ChemicalBook--->CAS DataBase List--->3569-10-6

3569-10-6

3569-10-6 Structure

3569-10-6 Structure
IdentificationMore
[Name]

VALERENIC ACID
[CAS]

3569-10-6
[Synonyms]

VALERENIC ACID
VALERENIC ACID SNAP-N-SHOOT 0.1mg/mL(P)
VALERENIC ACID(AHP)
VALERENIC ACID WITH HPLC
(E)-3-[(4S)-2,4,5,6,7,7aα-Hexahydro-3,7β-dimethyl-1H-inden-4-yl]-2-methylpropenoic acid
[Molecular Formula]

C15H22O2
[MDL Number]

MFCD00075694
[Molecular Weight]

234.33
[MOL File]

3569-10-6.mol
Chemical PropertiesBack Directory
[Melting point ]

134-139°C
[Boiling point ]

374.5±21.0 °C(Predicted)
[density ]

1.06±0.1 g/cm3(Predicted)
[storage temp. ]

−20°C
[solubility ]

Chloroform (Slightly), Ethanol (Slightly),Methanol (Slightly)
[form ]

neat
[pka]

4.88±0.19(Predicted)
[color ]

White to Off-White
[BRN ]

3138020
[LogP]

5.188 (est)
[CAS DataBase Reference]

3569-10-6(CAS DataBase Reference)
Safety DataBack Directory
[WGK Germany ]

3
[RTECS ]

UD3357700
[F ]

8-10
[HS Code ]

2916205000
Raw materials And Preparation ProductsBack Directory
[Preparation Products]

1-Pentanol-->Valeronitrile-->Ethyl valerate-->Valeryl chloride
Hazard InformationBack Directory
[Uses]

Valerenic Acid, acts as a subtype-selective GABAA receptor agonist in neonatal rat brainstem preparations. It can be used for the synthesis of Valerena-4,7(11)-diene, a highly active sedative.
[Definition]

ChEBI: A monocarboxylic acid that is 2-methylprop-2-enoic acid which is substituted at position 3 by a 3,7-dimethyl-2,4,5,6,7,7a-hexahydro-1H-inden-4-yl group. A bicyclic sesquiterpenoid constituent of the essential oil of the Valerian plant.
[Biological Activity]

Positive allosteric modulator of GABA A receptors that displays preference for receptors containing β 2 or β 3 subunits. Directly activates the receptor and also blocks the channel at high concentrations. Displays a sedative and anxiolytic activity in vivo . Also acts as a partial? agonist of 5-HT 5A receptors.
[in vivo]

Valerenic acid (1-6 mg/kg i.p. or 10 mg/kg p.o.) decreases the aversion of wild type mice to the lit area[2].
Valerenic acid (10 mg/kg; p.o.) increases the proportion of time 129X1/SvJ mice spent onto the open arms[2].

[IC 50]

GABAA; 5-HT5A Receptor: 17.2 μM (IC50)
[storage]

Store at -20°C
Well-known Reagent Company Product InformationBack Directory
[Sigma Aldrich]

3569-10-6(sigmaaldrich)
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