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Senna

HCID 73111
ノート反応
基本情報概要名称と識別子物性安全と法規制化学と産業関連反応化合物ノート
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基本情報

CAS
8013-11-4
標準SMILES
O=C(O)c1cc(O)c2c(c1)[C@H]([C@H]1c3cc(C(=O)O)cc(O)c3C(=O)c3c(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)cccc31)c1cccc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c1C2=O
InChIKey
IPQVTOJGNYVQEO-KGFNBKMBSA-N
分子式
C42H38O20
平均分子量
862.7 g/mol
単同位体質量
862.1956436

概要

Senna (powdered) is a yellow-brown powder with a slight odor and taste. (NTP, 1992)

名称と識別子

優先名称
Senna
IUPAC
(9R)-9-[(9R)-2-carboxy-4-hydroxy-10-oxo-5-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-9H-anthracen-9-yl]-4-hydroxy-10-oxo-5-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-9H-anthracene-2-carboxylic acid
英語名
Cassia
分子式
C42H38O20
分子量
0

名称と別名

SENNADosaflexGentlaxSennalaxSenolaxBlack Draught8013-11-4CCRIS 7489RefChem:56008Sennoside A81-27-6C42H38O20
名称をさらに表示
センナエキスD04395finepowderSenna (usp)Senokot (tn)SENNA,POWDEREDSenna extract (jan)CASSAVA STARCH, SENNA
MFCD00151527SenokotMoivatDTXSID1023576(9R)-9-[(9R)-2-carboxy-4-hydroxy-10-oxo-5-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-9H-anthracen-9-yl]-4-hydroxy-10-oxo-5-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-9H-anthracene-2-carboxylic acid2F1O30GVXH(9R,9'R)-4,4'-Dihydroxy-10,10'-dioxo-5,5'-bis(((2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)-9,9',10,10'-tetrahydro-[9,9'-bianthracene]-2,2'-dicarboxylic acidSENNOSIDES SENNOSIDE A [MI]

データベース識別子

CAS
8013-11-4、81-27-6
PubChem CID
73111
DTXSID
DTXSID1023576
ChEMBL
CHEMBL2368547

物性

構造計算による物性

XLogP
1.2
極性表面積
348 Ų
水素結合供与体数
12
水素結合受容体数
20
回転可能結合数
9
重原子数
62
形式電荷
0
複雑度
1,550

実験および物理化学的性質

LipidsPolyketides [PK] -> Aromatic polyketides [PK13] -> Anthracenes and phenanthrenes [PK1304]
Solubilityless than 1 mg/mL at 66 °F (NTP, 1992)
Dietary IngredientsSenna
Human Drugs · 2 件

Breast Feeding; Lactation; Milk, Human; Cathartics; Gastrointestinal Agents

Laxatives

Melting Point · 2 件

392 °F approximately (decomposes) (NTP, 1992)

220 - 243 °C

Physical Description · 2 件

Senna (powdered) is a yellow-brown powder with a slight odor and taste. (NTP, 1992)

Solid

物理化学的性質

安定性
安定。鉱酸、炭酸塩、石灰水、重金属の塩とは相容れない。
CAS データベース
8013 · 8013-11-4
EPAの化学物質情報
Senna alexandrina (8013-11-4)

化学的性質

化学的特性yellow, tan or brown powder

安全と法規制

安全情報は参考情報です。供給元の安全データシート(SDS)、適用法令、専門家による評価に代わるものではありません。

GHS分類

GHS Classification · 6 件

Danger

H302 (66.7%): Harmful if swallowed [Warning Acute toxicity, oral]

P233, P260, P261, P264, P270, P271, P272, P280, P284, P301+P317, P302+P352, P304+P340, P321, P330, P333+P317, P342+P316, P362+P364, P403, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 6 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Danger

H334 (100%): May cause allergy or asthma symptoms or breathing difficulties if inhaled [Danger Sensitization, respiratory]

危険有害性情報

Regulatory Information · 2 件

Chemical: [9,9′-Bianthracene]-2,2′-dicarboxylic acid, 5,5′-bis(.beta.-D-glucopyranosyloxy)-9,9′,10,10′-tetrahydro-4,4′-dihydroxy-10,10′-dioxo-, (9R,9′R)-

Chemical: Cassia

Other Safety InformationIMAP assessments - Senna: Environment tier I assessment
Fire HazardsFlash point data for this compound are not available; however, it is probably combustible. (NTP, 1992)
Health Hazards · 1 件

SYMPTOMS: Symptoms of exposure to this compound may include purging and blood in the stools. It can cause collapse. Griping and abortion also occur. The urine may acquire a marked yellow color, which changes to red on the addition of alkali. (NTP, 1992)

Reactive GroupAcids, Carboxylic
Reactivity ProfileSENNA (POWDERED) is incompatible with mineral acids, carbonates, infusion cinchona, lime water, salts of heavy metals and tartar emetic (NTP, 1992).
Air and Water Reactions

化学と産業

薬理情報

ATC CodeA06AB06
Cellular LocationsCytoplasm

応用分野

一般的な説明Yellow-brown powder with a slight odor and taste.

サプライヤー1 社

BOC Sciences+1-631-485-4226 · [email protected]

関連反応

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化合物ノート

読み込み中…

このページの内容基本情報概要名称と識別子物性安全と法規制化学と産業関連反応化合物ノート
ChEBI
CHEBI:9112
UNII
2F1O30GVXH
EC Number
201-339-9、687-679-2
Nikkaji
J209.363D
Insoluble in water.
Hazard Classes and CategoriesAcute Tox. 4 (66.7%)

安全と保護具

Fire FightingFires involving this material can be controlled with a dry chemical, carbon dioxide or Halon extinguisher. (NTP, 1992)
First Aid · 1 件

EYES: First check the victim for contact lenses and remove if present. Flush victim's eyes with water or normal saline solution for 20 to 30 minutes while simultaneously calling a hospital or poison control center. Do not put any ointments, oils, or medication in the victim's eyes without specific instructions from a physician. If symptoms (such as redness or irritation) develop, immediately transport the victim to a hospital.

Nonfire Spill Response · 1 件

SMALL SPILLS AND LEAKAGE: If you spill this chemical, you should dampen the solid spill material with water, then transfer the dampened material to a suitable container. Use absorbent paper dampened with water to pick up any remaining material. Seal your contaminated clothing and the absorbent paper in a vapor-tight plastic bag for eventual disposal. Wash all contaminated surfaces with a soap and water solution. Do not reenter the contaminated area until the Safety Officer (or other responsible person) has verified that the area has been properly cleaned.

Personal Protective Equipment (PPE) · 1 件

RECOMMENDED RESPIRATOR: Where the neat test chemical is weighed and diluted, wear a NIOSH-approved half face respirator equipped with an organic vapor/acid gas cartridge (specific for organic vapors, HCl, acid gas and SO2) with a dust/mist filter. (NTP, 1992)

毒性情報

Hepatotoxicity · 1 件

Use of senna in the recommended doses for a limited period of time has been associated with few side effects, most of which are mild and transient and related to its laxative action. With longer term and higher dose use of senna, however, adverse events have been described including several cases of clinically apparent liver injury. The time to onset of liver injury was usually after 3 to 5 months of use, and the pattern of serum enzyme elevations was hepatocellular. The liver injury was usually mild-to-moderate in severity and resolved rapidly with discontinuation. In at least one instance, reexposure led to rapid recurrence of liver injury. Immunoallergic features and autoimmune markers were not present in the published cases.

Effects During Pregnancy and Lactation◉ Summary of Use during Lactation

安全データ

危険有害性情報
コード 危険有害性情報 危険有害性クラス 区分 注意喚起語 シンボル P コード H334