Amotosalen
基本情報
- CAS
161262-29-9- 標準SMILES
Cc1oc2c(C)c3oc(=O)cc(C)c3cc2c1COCCN- InChIKey
FERWCFYKULABCE-UHFFFAOYSA-N- 分子式
- C17H19NO4
- 平均分子量
- 301.34 g/mol
- 単同位体質量
- 301.13140809
概要
Amotosalen is a synthetic psoralen, light-activated DNA and RNA crosslinking agent, with protective activity against pathogens such as bacteria, viruses, protozoa, and leukocytes. Prior to administration amotosalen is added to plasma and platelets, then in vivo this agent penetrates pathogens and targets DNA and RNA. Upon activation by ultraviolet A light, this agent is able to form interstrand DNA and RNA crosslinks and prevents replication. Inactivation of leukocytes can prevent graft versus host disease upon transfusion.
名称と識別子
- 優先名称
- Amotosalen
- IUPAC
- 3-(2-aminoethoxymethyl)-2,5,9-trimethylfuro[3,2-g]chromen-7-one
名称と別名
Amotosalen161262-29-9K1LDZ0VBC0amotosaleneamotosaleno7H-Furo(3,2-g)(1)benzopyran-7-one, 3-((2-aminoethoxy)methyl)-2,5,9-trimethyl-DTXSID708700753-((2-AMINOETHOXY)METHYL)-2,5,9-TRIMETHYL-7H-FURO(3,2-G)CHROMEN-7-ONEamotosalenumRefChem:112260DTXCID30200970Amotosalen free base
名称をさらに表示
Amotosalen [INN]UNII-K1LDZ0VBC03-(2-aminoethoxymethyl)-2,5,9-trimethylfuro[3,2-g]chromen-7-one3-((2-Aminoethoxy)methyl)-2,5,9-trimethyl-7H-furo(3,2-g)(1)benzopyran-7-one3-[(2-Aminoethoxy)methyl]-2,5,9-trimethyl-7H-furo[3,2-g][1]benzopyran-7-one161262-29-9 (free base)AMOTOSALEN [WHO-DD]SCHEMBL599618
データベース識別子
- CAS
161262-29-9- PubChem CID
- 159599
- DTXSID
DTXSID70870075- ChEMBL
CHEMBL2110621- UNII
- K1LDZ0VBC0
- Nikkaji
- J2.474.631C
物性
構造計算による物性
- XLogP
- 1.7
- 極性表面積
- 74.7 Ų
- 水素結合供与体数
- 1
- 水素結合受容体数
- 5
- 回転可能結合数
- 4
- 重原子数
- 22
- 形式電荷
- 0
- 複雑度
- 464
化学と産業
薬理情報
MeSH Pharmacological Classification
Drugs used to treat or prevent skin disorders or for the routine care of skin.
Drugs that are pharmacologically inactive but when exposed to ultraviolet radiation or sunlight are converted to their active metabolite to produce a beneficial reaction affecting the diseased tissue. These compounds can be administered topically or systemically and have been used therapeutically to treat psoriasis and various types of neoplasms.
関連反応
0 件
現在のフィルター条件では反応記録がありません。
化合物ノート
読み込み中…