ChemicalBook--->CAS DataBase List--->22139-77-1

22139-77-1

22139-77-1 Structure

22139-77-1 Structure
IdentificationBack Directory
[Name]

PINOSYLVIN
[CAS]

22139-77-1
[Synonyms]


Pisylvin
Nsc362430
PINOSYLVIN
pinosylvine
AKOS 211-07
(E)-pinosylvin
3,5-stilbenediol
5-Styrylresorcinol
(e)-5-stilbenediol
(E)-3,5-Stilbenediol
3,5-DIHYDROXY-STILBENE
3,5-TRANS-DIHYDROXYSTILBENE
trans-3,5-Dihydroxystilbene
(E)-5-styrylbenzene-1,3-diol
5-(2-Phenylethenyl)benzene-1,3-diol
5-(2-phenylethenyl)-3-benzenedio(e)-
5-[(E)-2-Phenylethenyl]-1,3-benzenediol
(e)-5-(2-phenylethenyl)-1,3-benzenediol
1,3-Benzenediol,5-[(1E)-2-phenylethenyl]-
[EINECS(EC#)]

683-184-0
[Molecular Formula]

C14H12O2
[MDL Number]

MFCD00210544
[MOL File]

22139-77-1.mol
[Molecular Weight]

212.24
Chemical PropertiesBack Directory
[Melting point ]

155.5-156°
[Boiling point ]

312.08°C (rough estimate)
[density ]

1.1035 (rough estimate)
[refractive index ]

1.6000 (estimate)
[storage temp. ]

2-8°C
[solubility ]

DMF: 10mg/mL; DMF:PBS (pH 7.2) (1:50): 0.01mg/mL; DMSO: 10mg/mL; Ethanol: 20mg/mL; Ethanol:PBS (pH 7.2) (1:50): 0.01mg/mL
[form ]

A solid
[pka]

9.34±0.10(Predicted)
[color ]

White to off-white
[BRN ]

1870942
[InChI]

InChI=1S/C14H12O2/c15-13-8-12(9-14(16)10-13)7-6-11-4-2-1-3-5-11/h1-10,15-16H/b7-6+
[InChIKey]

YCVPRTHEGLPYPB-VOTSOKGWSA-N
[SMILES]

C1(O)=CC(/C=C/C2=CC=CC=C2)=CC(O)=C1
[LogP]

3.680 (est)
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)Environment (GHS09)
GHS07,GHS09
[Signal word ]

Warning
[Hazard statements ]

H315-H319-H335-H400
[Precautionary statements ]

P273-P302+P352-P305+P351+P338
[Hazard Codes ]

Xn,N
[Risk Statements ]

22-36-51/53
[Safety Statements ]

26-61
[RIDADR ]

UN 3077 9 / PGIII
[WGK Germany ]

3
[RTECS ]

WJ5580000
Hazard InformationBack Directory
[Chemical Properties]

Off-white crystalline powder
[Uses]

Pinosylvin, a pre-infectious stilbenoid toxin, is used to study its properties as a fungitoxin and therapeutic agent. Pinosylvin is used as a representative stilbene to study its biological actions and therapeutic value in processes such as cell survival, apoptosis and cell mobility.
[Definition]

ChEBI: Pinosylvin is a stilbenol.
[General Description]

This substance is a primary reference substance with assigned absolute purity (considering chromatographic purity, water, residual solvents, inorganic impurities). The exact value can be found on the certificate. Produced by PhytoLab GmbH & Co. KG
[Enzyme inhibitor]

This trans-stilbene derivative (FW = 212.25 g/mol; CAS 102-61-4; M.P. = 155.5-156°C; low solubility in water), also known as (E)-3,5-stilbenediol and trans-3,5-dihydroxystilbene and named systematically as 5-[(E)-2- phenylethenyl]benzene-1,3-diol, occurs naturally in the hardwood of pine and other woody plants. Pinosylvin exxhibits micromolar Ki values for specific isozymes of stilbene synthase and chalcone synthase. Target(s): chalcone synthase; stilbene synthase; tyrosinase, or monophenol monooxygenase.
[storage]

4°C, protect from light
Spectrum DetailBack Directory
[Spectrum Detail]

PINOSYLVIN(22139-77-1)1HNMR
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