基本情報
- CAS
56-92-8- 標準SMILES
Cl.Cl.NCCc1cnc[nH]1- InChIKey
PPZMYIBUHIPZOS-UHFFFAOYSA-N- 分子式
- C5H9N3.2ClH
- 平均分子量
- 184.06 g/mol
- 単同位体質量
- 183.0330028
概要
Histamine Dihydrochloride is the hydrochloride salt form of histamine, with potential immunomodulatory and antineoplastic activities. Upon administration, histamine targets, binds to and activates histamine receptors. Depending on the amount of histamine administered and the type of receptor that is activated, histamine may exert a wide variety of activities. These can range from pro-tumorigenic to anti-tumor effects and may modulate the immune system to exert anti-tumor immune effects or may contribute to an inflammatory response.
名称と識別子
- 優先名称
- Histamine Dihydrochloride
- IUPAC
- 2-(1H-imidazol-5-yl)ethanamine;dihydrochloride
- 現地名
- ヒスタミン二塩酸塩
- 英語名
- Histamine dihydrochloride
- 分子式
- C5H11Cl2N3
- 分子量
- 184.07
名称と別名
Histamine dihydrochloride56-92-8pereminCeplene1H-Imidazole-4-ethanamine, dihydrochloridehistaminum hydrochloricum3POA0Q644UROPANA Pain Relief CreamNSC-257873DTXSID10587671H-Imidazole-5-ethanamine, hydrochloride (1:2)Glucosamine Cream EXTRA STRENGTH
名称をさらに表示
ヒスタミン二塩酸塩1H-イミダゾール-4-エタンアミン·2塩酸塩ヒスタミン·2塩酸塩酸ヒスタミン2-(1H-イミダゾール-4-イル)エタンアミン·2塩酸塩2-(1H-イミダゾール-5-イル)エタンアミン·二塩酸塩2-(1H-イミダゾール-4-イル)エチルアミン·2塩酸塩ヒスタミン塩酸塩ペレミンヒスタミン2塩酸塩ヒスタミン二塩酸塩(二塩酸ヒスタミン)ヒスタミン二塩酸塩標準品ヒスタミン 二塩酸塩2-(4-イミダゾリル)エチルアミン二塩酸塩HISTAMINE 2HCLHistaMine dihdrochlorideOCHLORIDEHistamine HCIHistaMine dihyHISTAMINE DIHCLhistaMine (HCl)2HistaMine Chloride
MaxamineHistamine 6XHistamine PhenolicNSC257873Histamine 1522RefChem:55301Pain Relieving ArthritisAustralian Dream Back Pain
物性
構造計算による物性
- 極性表面積
- 54.7 Ų
- 水素結合供与体数
- 4
- 水素結合受容体数
- 2
- 回転可能結合数
- 2
- 重原子数
- 10
- 形式電荷
- 0
- 複雑度
- 64.7
実験および物理化学的性質
Human DrugsEMA approved medicines: Human medicine
Collision Cross Section120.3 Ų [M+H]+ [CCS Type: TW; Method: calibrated with polyalanine and drug standards]
物理化学的性質
- 融点
- 249 · 249-252 °C(lit.)
- 貯蔵温度
- 2 · 2-8°C
- 溶解性
- 2 O: · H2O: 0.1 g/mL 無色透明
- 外見
- 粉
- 色
- ホワイトからオフホワイト
- 水溶解度
- 溶ける
- Merck
- 14 · 14,4719
- BRN
- 3624116 · 3624116
- 安定性
- 安定。強力な酸化剤とは相容れない。
- InChI
- InChI=1S/C5H9N3.2ClH/c6-2-1-5-3-7-4-8-5;;/h3-4H,1-2,6H2,(H,7,8);2*1H
- InChIKey
- PPZMYIBUHIPZOS-UHFFFAOYSA-N
- SMILES
- C1(N=CNC=1)CCN.Cl.Cl
- CAS データベース
- 56 · 56-92-8(CAS DataBase Reference)
- EPAの化学物質情報
- 1 H-Imidazole-4-ethanamine, · 1H-Imidazole-4-ethanamine, dihydrochloride (56-92-8)
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
This chemical does not meet GHS hazard criteria for 1% (1 of 98) of reports.
Danger
H315 (99%): Causes skin irritation [Warning Skin corrosion/irritation]
P233, P260, P261, P264, P264+P265, P271, P272, P280, P284, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P333+P317, P337+P317, P342+P316, P362+P364, P403, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 98 reports by companies from 17 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
危険有害性情報
Regulatory Information
Chemical: 1H-Imidazole-5-ethanamine, hydrochloride (1:2)
REACH registered substance: 2-imidazol-4-ylethylamine dihydrochloride (EC: 200-298-4)
1H-Imidazole-4-ethanamine, dihydrochloride: Does not have an individual approval but may be used under an appropriate group standard
Hazard Classes and CategoriesSkin Irrit. 2 (99%)
安全データ
- F
- 1-8-9
- wgk
- 2
- tsca
- TSCA listed
- rtecs
- MS1575000
- ridadr
- 3335
- hs_code
- 29332900
- risk_code
- 36/37/38-42/43-42-22
- hazard_code
- Xn,Xi
- safety_code
- 22-26-36/37/39-45-37-36/37
- hazard_class
- IRRITANT
- Hazard Classifications
- Eye Irrit. 2Resp. Sens. 1Skin Irrit. 2Skin Sens. 1STOT SE 3
化学と産業
薬理情報
ATC Code
L - Antineoplastic and immunomodulating agents
QL - Antineoplastic and immunomodulating agents
MeSH Pharmacological ClassificationDrugs that bind to and activate histamine receptors. Although they have been suggested for a variety of clinical applications histamine agonists have so far been more widely used in research than therapeutically.
用途と製造
General Manufacturing Information1H-Imidazole-5-ethanamine, hydrochloride (1:2): ACTIVE
応用分野
用途生理作用研究用。
使用Histamine dihydrochloride has been shown to activate nitric oxide synthetase and suppress or inhibit the generation of reactive oxygen species (ROS). Inhibition of ROS by histamine dihydrochloride allows activation of T cells and NK cells by IL-2. In a rat model, histamine dihydrochloride suppressed ROS generated by Kupffer cells through the H2 histamine receptor. It is a potent vasodilator and endogenous histamine receptor agonist.
一般的な説明Histamine Dihydrochloride is a derivative of histamine, which is implicated in tumor cell apoptosis and prevents the relapse of acute myeloid leukemia in patients. It prevents the formation of ROS (reactive oxygen species) and inhibits the activation of T cells and natural killer cells.Pharmaceutical secondary standards for application in quality control, provide pharma laboratories and manufacturers with a convenient and cost-effective alternative to the preparation of in-house working standards.
調製方法
純化方法The dihydrochloride crystallises from aqueous EtOH. The phosphate (2H3PO4) [51-74-1] has m 132-133o (from H2O). [Beilstein 25 III/IV 2049.]
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