基本情報
- 標準SMILES
C=C1C[C@@]23CC[C@H]4[C@@](C)(CCC[C@@]4(C)C(=O)O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)[C@@H]2CC[C@]1(O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)C3- InChIKey
UEDUENGHJMELGK-HYDKPPNVSA-N- 分子式
- C38H60O18
- 平均分子量
- 804.9 g/mol
- 単同位体質量
- 804.37796506
名称と識別子
- 優先名称
- Stevioside
- IUPAC
- [(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] (1R,4S,5R,9S,10R,13S)-13-[(2S,3R,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-5,9-dimethyl-14-methylidenetetracyclo[11.2.1.01,10.04,9]hexadecane-5-carboxylate
- 現地名
- ステビオシド
- 英語名
- Stevioside
- 分子式
- C38H60O18
- 分子量
- 804.88
名称と別名
名称をさらに表示
データベース識別子
- CAS
57817-89-7- PubChem CID
- 442089
- DTXSID
DTXSID7021281- ChEMBL
CHEMBL444122- ChEBI
CHEBI:9271- UNII
- 0YON5MXJ9P
- EC Number
- 260-975-5
- Nikkaji
- J27.441K
物性
構造計算による物性
- XLogP
- -1.2
- 極性表面積
- 295 Ų
- 水素結合供与体数
- 11
- 水素結合受容体数
- 18
- 回転可能結合数
- 10
- 重原子数
- 56
- 形式電荷
- 0
- 複雑度
- 1,450
実験および物理化学的性質
物理化学的性質
- 融点
- 198 °C · 198°C
- 沸点
- 963.3 · 963.3±65.0 °C(Predicted)
- 比旋光度
- 25 · D25 -39.3° (c = 5.7 in H2O)
- 比重(密度)
- 1.53 · 1.53±0.1 g/cm3(Predicted)
- 屈折率
- -39.3 ° · -39.3 ° (C=6, H2O)
- FEMA
- 4728 · 4728 | GLUCOSYL STEVIOL GLYCOSIDES
- 貯蔵温度
- 2 · Sealed in dry,2-8°C
- 溶解性
- 25 mg/mL、透明 · DMSO:可溶25mg/mL、透明
- 外見
- 粉
- 酸解離定数(Pka)
- 12.51 · 12.51±0.70(Predicted)
- 色
- 白い
- 由来生物
- Stevia sp.
- Merck
- 14 · 14,8810
- 主な用途
- 洗浄剤化粧品食品および飲料パーソナルケア
- 化粧品成分の機能
- 口腔ケア香料
- InChIKey
- ZBXJPXVJLBZBLI-IJGGXEOMSA-N
- LogP
- 4.44 · 4.440 (est)
- CAS データベース
- 57817 · 57817-89-7(CAS DataBase Reference)
化学的性質
化学的特性White powder
安全と法規制
GHS分類
GHS Classification
This chemical does not meet GHS hazard criteria for 85.7% (6 of 7) of all reports.
Warning
H315 (14.3%): Causes skin irritation [Warning Skin corrosion/irritation];H317 (14.3%): May cause an allergic skin reaction [Warning Sensitization, Skin];H319 (14.3%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
P261, P264, P264+P265, P272, P280, P302+P352, P305+P351+P338, P321, P332+P317, P333+P317, P337+P317, P362+P364, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 7 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.;Reported as not meeting GHS hazard criteria per 6 of 7 reports by companies.;There is 1 notification provided by 1 of 7 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
Regulatory Information
Chemical: Kaur-16-en-18-oic acid, 13-[(2-O-.beta.-D-glucopyranosyl-.beta.-D-glucopyranosyl)oxy]-, .beta.-D-glucopyranosyl ester, (4.alpha.)-
Kaur-16-en-18-oic acid, 13-(2-O-.beta.-D-glucopyranosyl-.beta.-D-glucopyranosyl)oxy-, .beta.-D-glucopyranosyl ester, (4.alpha.)-: Does not have an individual approval but may be used under an appropriate group standard
法規制情報
Regulatory Information
Chemical: Kaur-16-en-18-oic acid, 13-[(2-O-.beta.-D-glucopyranosyl-.beta.-D-glucopyranosyl)oxy]-, .beta.-D-glucopyranosyl ester, (4.alpha.)-
Kaur-16-en-18-oic acid, 13-(2-O-.beta.-D-glucopyranosyl-.beta.-D-glucopyranosyl)oxy-, .beta.-D-glucopyranosyl ester, (4.alpha.)-: Does not have an individual approval but may be used under an appropriate group standard
安全データ
- wgk
- 3
- rtecs
- NZ8175000
- hs_code
- 29389090
- safety_code
- 22-24/25
- ストレージクラス
- 11 - Combustible Solids
化学と産業
薬理情報
用途と製造
Use Classification
Food Additives -> SWEETENER -> JECFA Functional Classes
Cosmetics -> Masking; Oral care
応用分野
解説ステビオシド,ステビオシドは吸湿性の結晶.融点198 ℃.[α]25D-39.3°(水).800 mL の水に1 g 溶けるが,有機溶媒に難溶.食品の甘味料として使用される.ステビオールC20H30O3(318.46)は針状結晶.融点215 ℃.[α]D-94.7°.植物生長促進作用をもっている.森北出版「化学辞典(第2版)
天然物の起源Stevioside is a naturally occurring sweetener (~200 times sweeter than sucrose) extracted from a South American plant, Stevia rebaudiana Bertoni. The dried leaves, the water extract of leaves, and the refined chemical ingredients, eg, and Rebaudioside A (~300 times sweeter than sucrose), can all be used as sweetening agents. These are collectively referred to as stevia. Discovered in Paraguay and Brazil, the plant was identified in the early 1970s as a plant of high economical value and transported to Japan for cultivation, where the commercialization of stevia leaves extract as a natural sweetener became a success. Today Stevia plant is cultivated primarily in China.
来歴Because no food additive petition has been presented to the FDA, stevioside and related materials cannot be used in the United States as food ingredients. An import alert against stevia was issued by the FDA in 1991. In 1995, however, the FDA revised this import alert to allow the importation and use of stevia as a dietary supplement, but not as a sweetener or an ingredient for foods. In 2004, JECFA (Joint Expert Committee of Food Additives) issued a preliminary ADI (Allowed Daily Intake) of 2-mg/kg body weight (based on steviol) for stevia extract. This action may impact favorably on worldwide regulatory approval. As consumer’s demand on naturally sweetened products increases, interest in Stevia, and naturally occurring potent sweeteners in general, is expected to grow. A comprehensive review of stevia is available [Kinghorn, 2002].
上流・下流製品情報
上流原料
下流製品
サプライヤー50 社
補足説明
定義本品は、ステビア Stevia rebaudiana から分離される炭水化物である。[Eupatorium rebaudianum]
関連反応
関連ノート
読み込み中…