基本情報
- CAS
120786-18-7- 標準SMILES
CC=C1C2C=C(C)CC1(N)c1ccc(=O)[nH]c1C2- InChIKey
ZRJBHWIHUMBLCN-UHFFFAOYSA-N- 分子式
- C15H18N2O
- 平均分子量
- 242.32 g/mol
- 単同位体質量
- 242.1419132
概要
LSM-1581 has been reported in Huperzia serrata with data available.
名称と識別子
- 優先名称
- Acanthus ilicifolius Linn
- IUPAC
- 1-amino-13-ethylidene-11-methyl-6-azatricyclo[7.3.1.02,7]trideca-2(7),3,10-trien-5-one
- 現地名
- フペルジンA
- 英語名
- Huperzine A
- 分子式
- C15H18N2O
- 分子量
- 242.32
名称と別名
Acanthus ilicifolius LinnRefChem:1075165(+/-)-Huperzine A120786-18-7Selagine1-amino-13-ethylidene-11-methyl-6-azatricyclo[7.3.1.02,7]trideca-2(7),3,10-trien-5-oneHupA(1R,9S,13E)-1-Amino-13-ethylidene-11-methyl-6-azatricyclo[7.3.1.02,7]trideca-2(7),3,10-trien-5-one(-)-Huperzine A (HupA)103735-86-0HB0001(+/-)Huperzine A
名称をさらに表示
HUPERAZINE AHUPERZINE A[+/-]-SELAGINE(+/-)-SELAGINE(±)-Huperzine A(+/-)-HuperzineA(+/-)-HUPERAZINE A(±)-Huperzine A, >98%
CBiol_001885BSPBio_001143KBioGR_000483KBioSS_000483SCHEMBL1047469CHEMBL3184073BDBM10441KBio2_000483
データベース識別子
- CAS
120786-18-7- PubChem CID
- 1253
- ChEMBL
物性
構造計算による物性
- XLogP
- 0
- 極性表面積
- 55.1 Ų
- 水素結合供与体数
- 2
- 水素結合受容体数
- 2
- 回転可能結合数
- 0
- 重原子数
- 18
- 形式電荷
- 0
- 複雑度
- 551
物理化学的性質
- 沸点
- 505 · 505.0±50.0 °C(Predicted)
- 比重(密度)
- 1.2 · 1.20±0.1 g/cm3(Predicted)
- 貯蔵温度
- 2 · 2-8°C
- 溶解性
- 50 mg/mL · DMSO : ≥ 50 mg/mL (206.34 mM)
- 外見
- オフホワイトの固体。
- 酸解離定数(Pka)
- 12.25 · 12.25±0.60(Predicted)
- 色
- White or off-white
- InChI
- InChI=1S/C15H18N2O/c1-3-11-10-6-9(2)8-15(11,16)12-4-5-14(18)17-13(12)7-10/h3-6,10H,7-8,16H2,1-2H3,(H,17,18)/b11-3+
- InChIKey
- ZRJBHWIHUMBLCN-QDEBKDIKSA-N
- SMILES
- C12CC3/C(=C\C)/C(N)(C=1C=CC(=O)N2)CC(C)=C3
- CAS データベース
- 120786 · 120786-18-7
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
Danger
H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral]
P261, P262, P264, P264+P265, P270, P271, P280, P301+P316, P302+P352, P304+P340, P305+P351+P338, P316, P319, P321, P330, P332+P317, P337+P317, P361+P364, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 39 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
危険有害性情報
Hazard Classes and CategoriesAcute Tox. 3 (100%)
安全データ
- wgk
- 3
- rtecs
- PB9185700
- ridadr
- UN 1544 6.1/PG 2
- risk_code
- 23/24/25-36/37/38
- hazard_code
- T
- safety_code
- 26-36/37/39-45
化学と産業
応用分野
説明Huperzine A is an alkaloid extract derived from the Chinese club moss Huperzia serrata. It is an acetylcholinesterase inhibitor. This means it helps promote higher levels of acetylcholine in the brain. Higher levels of acetylcholine support ones ability to perform cognitive tasks such as learning new things, memorizing information, and focusing at the task at hand. Huperzine A is considered to be a nootropic supplement because it supports cognitive function. It is considered a focus and memory nootropic similar to alpha gpc, bacopa, phosphatidylcholine, cdp choline, sulbutiamine, and uridine. It is also considered a brain booster as it is used for brain health and support.Huperzine A for many years has been widely used in traditional Chinese medicine to enhance memory and to treat fever and inflammation. In the United States it is commercially available as a food supplement, but has not been approved by the FDA as a treatment for AD or other cognition disorders.
天然物の起源Huperzine A is a synthetic.
使用Huperzine A is used for dementia in Alzheimer’s disease and for muscle weakness in myasthenia gravis.
上流・下流製品情報
上流原料
サプライヤー100 社
北京华美互利生物化工
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