(2R)-2β,7,8-トリメチル-2-[(3E,7E)-4,8,12-トリメチル-3,7,11-トリデカトリエニル]-3,4-ジヒドロ-2H-1-ベンゾピラン-6-オール

Gamma-Tocotrienol

HCID 5282349
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基本情報

CAS
14101-61-2
標準SMILES
CC(C)=CCC/C(C)=C/CC/C(C)=C/CC[C@]1(C)CCc2cc(O)c(C)c(C)c2O1
InChIKey
OTXNTMVVOOBZCV-WAZJVIJMSA-N
分子式
C28H42O2
平均分子量
410.6 g/mol
単同位体質量
410.31848058

名称と識別子

優先名称
Gamma-Tocotrienol
IUPAC
(2R)-2,7,8-trimethyl-2-[(3E,7E)-4,8,12-trimethyltrideca-3,7,11-trienyl]-3,4-dihydrochromen-6-ol
現地名
(2R)-2β,7,8-トリメチル-2-[(3E,7E)-4,8,12-トリメチル-3,7,11-トリデカトリエニル]-3,4-ジヒドロ-2H-1-ベンゾピラン-6-オール
英語名
D-gamma-Tocotrienol
分子式
C28H42O2
分子量
410.63

名称と別名

gamma-Tocotrienol14101-61-2185QAE24TRJ13.903C(2R)-2,7,8-trimethyl-2-[(3E,7E)-4,8,12-trimethyltrideca-3,7,11-trienyl]-3,4-dihydrochromen-6-olCHEBI:33277DTXSID1010199842H-1-Benzopyran-6-ol, 3,4-dihydro-2,7,8-trimethyl-2-(4,8,12-trimethyl-3,7,11-tridecatrienyl)-, (R-(E,E))-2H-1-BENZOPYRAN-6-OL, 3,4-DIHYDRO-2,7,8-TRIMETHYL-2-((3E,7E)-4,8,12-TRIMETHYL-3,7,11-TRIDECATRIEN-1-YL)-, (2R)-2H-1-Benzopyran-6-ol, 3,4-dihydro-2,7,8-trimethyl-2-(4,8,12-trimethyl-3,7,11-tridecatrienyl)-, [R-(E,E)]-2R,7,8-trimethyl-2-[(3E,7E)-4,8,12-trimethyltrideca-3,7,11-trien-1-yl]-3,4-dihydro-2H-chromen-6-oltocotrienol, gamma
名称をさらに表示
γ-トコトリエノール(R)-3,4-ジヒドロ-2,7,8-トリメチル-2-[(3E,7E)-4,8,12-トリメチル-3,7,11-トリデカトリエニル]-2H-1-ベンゾピラン-6-オール(2R)-2β,7,8-トリメチル-2-[(3E,7E)-4,8,12-トリメチル-3,7,11-トリデカトリエニル]-3,4-ジヒドロ-2H-1-ベンゾピラン-6-オールGama-トコトリエノール(2R)-2,7,8-トリメチル-2-[(3E,7E)-4,8,12-トリメチルトリデカ-3,7,11-トリエン-1-イル]-3,4-ジヒドロ-2H-1-ベンゾピラン-6-オール(2R)-2-[(3E,7E)-4,8,12-トリメチル-3,7,11-トリデカトリエニル]-2,7,8-トリメチル-3,4-ジヒドロ-2H-1-ベンゾピラン-6-オールγ-Tocotrienolγ-TocotrienolD-G-TOCOTRIENOLD-γ-TocotrienolGama-Tocotrienol(R)-gamma-Tocotrienol(-)-gamma-TocotrienolTOCOTRIENOL, D-GAMMA-Senecionine Impurity 4
(2R)-2,7,8-trimethyl-2-((3E,7E)-4,8,12-trimethyltrideca-3,7,11-trienyl)-3,4-dihydrochromen-6-ol2H-1-Benzopyran-6-ol, 3,4-dihydro-2,7,8-trimethyl-2-[(3E,7E)-4,8,12-trimethyl-3,7,11-tridecatrien-1-yl]-, (2R)-2R,7,8-trimethyl-2-((3E,7E)-4,8,12-trimethyltrideca-3,7,11-trien-1-yl)-3,4-dihydro-2H-chromen-6-olRefChem:639608DTXCID901477841plastochromanol 8, plastochromanol 3604-216-1D-gamma-Tocotrienol

データベース識別子

CAS
14101-61-2
PubChem CID
5282349
DTXSID
DTXSID101019984
ChEMBL
CHEMBL120697
ChEBI
CHEBI:33277
UNII
185QAE24TR
EC Number
604-216-1
Nikkaji
J13.903C

物性

構造計算による物性

XLogP
8.9
極性表面積
29.5 Ų
水素結合供与体数
1
水素結合受容体数
2
回転可能結合数
9
重原子数
30

実験および物理化学的性質

Physical DescriptionSolid
Kovats Retention Index · 2 件

3170.9

3083

物理化学的性質

沸点
530.8 · 530.8±49.0 °C(Predicted)
比重(密度)
0.964 · 0.964±0.06 g/cm3(Predicted)
貯蔵温度
20 °C · −20°C
溶解性
クロロホルム（微量）、酢酸エチル（微量）、メタノール（微量）
外見
Liquid
酸解離定数(Pka)
11.05 · 11.05±0.40(Predicted)

化学的性質

化学的特性g:d:aTocotrienol 1.6:0.4:1

安全と法規制

GHS分類

GHS Classification · 3 件

This chemical does not meet GHS hazard criteria for 100% (104 of 104) of all reports.

Not Classified；Reported as not meeting GHS hazard criteria by 104 of 104 companies. For more detailed information, please visit ECHA C&L website.

Aggregated GHS information provided per 104 reports by companies from 1 notifications to the ECHA C&L Inventory.；Reported as not meeting GHS hazard criteria per 104 of 104 reports by companies.；There are 0 notifications provided by 0 of 104 reports by companies with hazard statement code(s).；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.

危険有害性情報

Hazard Classes and CategoriesNot Classified

安全データ

wgk
2
ストレージクラス
10 - Combustible liquids

化学と産業

薬理情報

Cellular LocationsExtracellular；Membrane
応用分野 · 2 件

説明γ-Tocotrienol is a form of vitamin E that has been found in rice bran and has diverse biological activities. It reduces cell death induced by hydrogen peroxide, paraquat, S-nitrocysteine, SIN-1 , or L-buthionine-(S,R)-sulfoximine (BSO; ) in rat striatal cultures when used at concentrations ranging from 0.1 to 10 μM. γ-Tocotrienol (20 μM) induces apoptosis in malignant sympathoadrenal (+SA) mouse mammary epithelial cells. In vivo, γ-tocotrienol (15, 30, and 150 mg/kg) reduces blood pressure and plasma lipid peroxide levels in spontaneously hypertensive rats. [Matreya, LLC. Catalog No. 2111]

使用γ-Tocotrienol exhibits antioxidant properties and belongs to the vitamin E family. It is naturally found in wheat germ oil and bran. In addition, α-tocopherol and γ-tocotrienol derivatives are potential lead compounds for developinganticancer andantiproliferative agents againstMCF-7 and MDA-MB-231 breast cancer cells and the A549 lung cancer cells.

サプライヤー89 社

南京世洲生物科技有限公司025-85560043 15850508050 · [email protected]
上海惠诚生物科技有限公司60498804 18930850192 · [email protected]
Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]
武汉英诺医药科技有限公司+86-027-59232304 15387063101 · [email protected]
成都超九八生物科技有限公司13348960310 13348960310 · [email protected]

補足説明

定義ChEBI: A tocotrienol that is chroman-6-ol substituted by methyl groups at positions 2, 7 and 8 and a farnesyl chain at position 2.

関連反応

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