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Honokiol

HCID 72303
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Grundinformationen

CAS
35354-74-6
Standard-SMILES
C=CCc1ccc(O)c(-c2ccc(O)c(CC=C)c2)c1
InChIKey
FVYXIJYOAGAUQK-UHFFFAOYSA-N
Summenformel
C18H18O2
Durchschnittliche Molmasse
266,3 g/mol
Monoisotopische Masse
266,13067981

Namen und Bezeichner

Bevorzugter Name
Honokiol
IUPAC
2-(4-hydroxy-3-prop-2-enylphenyl)-4-prop-2-enylphenol
Englischer Name
Honokiol
Summenformel
C18H18O2
Molmasse
266.33

Namen und Synonyme

Honokiol35354-74-63,5'-Diallyl-4,2'-dihydroxybiphenylPurinol4-allyl-2-(3-allyl-4-hydroxy-phenyl)phenol2-(4-hydroxy-3-prop-2-enylphenyl)-4-prop-2-enylphenolDTXSID3018884511513CCO0NFMLT BSASM HNSC-293100(1,1'-BIPHENYL)-2,4'-DIOL, 3',5-DI-2-PROPEN-1-YL-RefChem:788486
Weitere Namen anzeigen
PiclidenosonMagnolia officinalis extracthnkMagnolia officinalis oilHonokiol D101’-Biphenyl]-2,4’-diol,3’,5-di-2-propenyl-[1houpaHonokiol>
DTXCID90111336609-119-85,3'-Diallyl-2,4'-dihydroxybiphenylNSC 2931003',5-Di-2-propen-1-yl[1,1'-biphenyl]-2,4'-diol3',5-diallyl-2,4'-biphenyldiolMFCD000166743',5-Diallylbiphenyl-2,4'-diol

Datenbank-Bezeichner

CAS
35354-74-6
PubChem CID
72303
DTXSID
DTXSID30188845
ChEMBL
CHEMBL16901
ChEBI
CHEBI:5759
UNII
11513CCO0N
EC Number
609-119-8
Nikkaji
J138.358B

Eigenschaften

Berechnete Struktureigenschaften

XLogP
5
Polarare Oberfläche (TPSA)
40,5 Ų
H-Brücken-Donoren
2
H-Brücken-Akzeptoren
2
Frei drehbare Bindungen
5
Schwere Atome
20
Formalladung
0
Komplexität
325

Physikochemische Eigenschaften

Schmelzpunkt
86 ℃ · 86℃
Siedepunkt
400.1 · 400.1±40.0 °C(Predicted)
Dichte
1.107 · 1.107±0.06 g/cm3(Predicted)
storage temp.
2 · 2-8°C
Löslichkeit
36 mg/mL · DMSO: 36 mg/mL
Aggregatzustand
powder
pka
9.89 · 9.89±0.48(Predicted)
Farbe
White to Off-White
Merck
14 · 14,4742
Stabilität
Light Sensitive
Major Application
food and beverages
Kosmetik-Inhaltsstoffe Funktionen
BLEACHINGANTIOXIDANTSKIN CONDITIONING
InChI
InChI=1S/C18H18O2/c1-3-5-13-7-9-18(20)16(11-13)14-8-10-17(19)15(12-14)6-4-2/h3-4,7-12,19-20H,1-2,5-6H2
InChIKey
FVYXIJYOAGAUQK-UHFFFAOYSA-N
SMILES
C1(C2=CC=C(O)C(CC=C)=C2)=CC(CC=C)=CC=C1O

Sicherheit und Regulatorisches

Sicherheitsangaben dienen nur zur Orientierung und ersetzen weder das Sicherheitsdatenblatt (SDB) des Lieferanten noch geltende Vorschriften oder eine fachliche Bewertung.

GHS-Klassifizierung

GHS Classification · 5 Einträge

Danger

H302 (27.7%): Harmful if swallowed [Warning Acute toxicity, oral];H315 (27.7%): Causes skin irritation [Warning Skin corrosion/irritation];H318 (47.5%): Causes serious eye damage [Danger Serious eye damage/eye irritation];H319 (52.5%): Causes serious eye irritation [Warning Serious eye damage/eye irritation];H335 (27.7%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation];H411 (36.6%): Toxic to aquatic life with long lasting effects [Hazardous to the aquatic environment, long-term hazard]

P261, P264, P264+P265, P270, P271, P273, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P305+P354+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P391, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 101 reports by companies from 5 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.;Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.

Gefahrenhinweise

Regulatory InformationHonokiol: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right.
Hazard Classes and CategoriesAcute Tox. 4 (27.7%);Skin Irrit. 2 (27.7%);Eye Dam. 1 (47.5%);Eye Irrit. 2 (52.5%);STOT SE 3 (27.7%);Aquatic Chronic 2 (36.6%)

Regulatorische Informationen

Chemie und Industrie

Pharmakologische Informationen

MeSH Pharmacological Classification · 6 Einträge

Agents used for the treatment or prevention of cardiac arrhythmias. They may affect the polarization-repolarization phase of the action potential, its excitability or refractoriness, or impulse conduction or membrane responsiveness within cardiac fibers. Anti-arrhythmia agents are often classed into four main groups according to their mechanism of action: sodium channel blockade, beta-adrenergic blockade, repolarization prolongation, or calcium channel blockade.

Substances that prevent infectious agents or organisms from spreading or kill infectious agents in order to prevent the spread of infection.

Drugs that are chemically similar to naturally occurring metabolites, but differ enough to interfere with normal metabolic pathways. (From AMA Drug Evaluations Annual, 1994, p2033)

Agents obtained from higher plants that have demonstrable cytostatic or antineoplastic activity.

A very loosely defined group of drugs that tend to reduce the activity of the central nervous system. The major groups included here are ethyl alcohol, anesthetics, hypnotics and sedatives, narcotics, and tranquilizing agents (antipsychotics and antianxiety agents).

Compounds or agents that combine with an enzyme in such a manner as to prevent the normal substrate-enzyme combination and the catalytic reaction.

Anwendungen · 3 Einträge

BeschreibungMagnolol is derived from the root bark and branch bark of magnolia or Magnolia officinalis. Magnolia officinalis was first written in the《ben jing》, it prefers cool and humid climate and well-drained acid soil. Cortex magnoliae officinalis (hou po) is mainly produced in Sichuan (Wan quan, Shizhu, Guanxian), Hubei (Shien,Yichang, Lichuan), Zhejiang (Longquan, Anhui), and other places. It is also distributed in Fujian, Jiangxi, Hunan, Guangxi, Yunnan, Guizhou, Shanxi, Gansu, and other places. Cortex magnoliae officinalis from Sichuan and Hubei is called “chuan pu,” with better quality, while in Zhejiang, it is called “warm park,” with a larger output.

HistoryIn 1930, magnolol was first isolated from the bark of Cortex magnoliae officinalis in China by Japanese Sugii, and it was also isolated from Cortex magnoliae officinalis in Japan. In 1973, magnolol and its isomers honokiol were isolated from Cortex magnoliae officinalis in China and Japan by Japanese Fujita. The drug research and development of magnolol and honokiol remain in pharmacological activity and preclinical research. Kyung Hee University from Korea declared a preclinical study in 2003, in which allergy, anxiety, angina, and heart failure are indications for honokiol.

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Auf dieser SeiteGrundinformationenNamen und BezeichnerEigenschaftenSicherheit und RegulatorischesChemie und IndustrieZugehörige ReaktionenNotizen zur Verbindung
LogP
4.2 · 4.200 (est)
CAS Datenbank
35354 · 35354-74-6(CAS DataBase Reference)
Regulatory InformationHonokiol: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right.

Sicherheitsdaten

wgk
3
ridadr
UN 3077 9/PG 3
hs_code
29072990
risk_code
41-51/53
hazard_code
Xi,N
safety_code
26-39-61
hazard_class
9
Speicherklasse
11 - Combustible Solids
Hazard Classifications
Aquatic Chronic 2Eye Dam. 1

VerwendenHonokiol is a small-molecule polyphenol isolated from the genus Magnolia. Recent studies show that Honokiol displays antiangiogenic, antiinflammatory, and antitumor properties in preclinical models, w ithout appreciable toxicity. Honokiol has been shown to inhibit the bone metastatic growth of human prostate cancer cells.

Vor- und nachgelagerte Produkte

Vorgelagerte Rohstoffe

2-Naphthalenemethanol, decahydro-8-[(2'-hydroxy-3,5'-di-2-propen-1-yl[1,1'-biphenyl]-4-yl)oxy]-α,α,4a,8-tetramethyl-, (2R,4aR,8R,8aR)-

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