基本情報
- CAS
10121-91-2- 標準SMILES
CN(C)c1cccc2c(S(=O)(=O)NCCCCCN)cccc12- InChIKey
MLEBFEHOJICQQS-UHFFFAOYSA-N- 分子式
- C17H25N3O2S
- 平均分子量
- 335.5 g/mol
- 単同位体質量
- 335.16674822
概要
Monodansylcadaverine is a sulfonamide obtained by formal condensation of the sulfo group of 5-(dimethylamino)naphthalene-1-sulfonic acid with one of the amino groups of cadaverine. It has a role as a protective agent, a fluorochrome and an EC 2.3.2.13 (protein-glutamine gamma-glutamyltransferase) inhibitor. It is a sulfonamide, an aminonaphthalene, a primary amino compound and a tertiary amino compound. It is functionally related to a cadaverine.
名称と識別子
- 優先名称
- Monodansylcadaverine
- IUPAC
- N-(5-aminopentyl)-5-(dimethylamino)naphthalene-1-sulfonamide
- 現地名
- N-(5-アミノペンチル)-5-(ジメチルアミノ)-1-ナフタレンスルホンアミド
- 英語名
- DANSYLCADAVERINE
- 分子式
- C17H25N3O2S
- 分子量
- 335.46
名称と別名
Dansylcadaverine10121-91-2monodansylcadaverine1-Naphthalenesulfonamide, N-(5-aminopentyl)-5-(dimethylamino)-I9N81SC5HDDTXSID40143788N-(5-Aminopentyl)-5-dimethylamino-1-naphthalenesulfonamideCHEBI:52007RefChem:159553DTXCID7066279233-326-9n-(5-aminopentyl)-5-(dimethylamino)naphthalene-1-sulfonamide
名称をさらに表示
N-(5-アミノペンチル)-5-(ジメチルアミノ)ナフタレン-1-スルホンアミド5-[[5-(ジメチルアミノ)ナフタレン-1-イルスルホニル]アミノ]-1-ペンタンアミン[5-(ジメチルアミノ)ナフタレン-1-イル][(5-アミノペンチル)アミノ]スルホンN-(5-アミノペンチル)-5-(ジメチルアミノ)-1-ナフタレンスルホンアミドモノダンシルカダベリンダンシルカダベリン5-<WBRDansylcadaverine, 10 mM in DMSOMONODANSYLCADAVERINE CRYSTALLINEDANSYLCADAVERINE, FOR FLUORESCENCEDANSYLCADAVERINE MONODANSYLCADAVERINEN-(DIMETHYL-AMINO-NAPHTHA-LENE-SULFONYL)-1
Monodansyl cadaverineMFCD00042704EINECS 233-326-9N-(5-Aminopentyl)-5-(dimethylamino)naphthalene-1-sulphonamideUNII-I9N81SC5HDMLEBFEHOJICQQS-UHFFFAOYSA-NN-(5-Aminopentyl)-5-(dimethylamino)-1-naphthalenesulfonamide; Dansylcadaverine; Monodansylcadaverine;N-monodansylcadaverine
物性
構造計算による物性
- XLogP
- 2.5
- 極性表面積
- 83.8 Ų
- 水素結合供与体数
- 2
- 水素結合受容体数
- 5
- 回転可能結合数
- 8
- 重原子数
- 23
- 形式電荷
- 0
- 複雑度
- 447
物理化学的性質
- 融点
- 137 · 137-140 °C
- 沸点
- 505.5 · 505.5±60.0 °C(Predicted)
- 比重(密度)
- 1.19 · 1.190±0.06 g/cm3(Predicted)
- 貯蔵温度
- 20 °C · −20°C
- 溶解性
- 10 mg/ml · Methanol: 10 mg/ml
- 外見
- 粉
- 酸解離定数(Pka)
- 11.96 · 11.96±0.50(Predicted)
- 色
- 黄色～黄緑色
- BRN
- 2951070 · 2951070
- 安定性
- -20 °C · -20°C の DMSO またはメタノール溶液で最大 1 か月間保存できます。
- InChI
- 1S/C17H25N3O2S/c1-20(2)16-10-6-9-15-14(16)8-7-11-17(15)23(21,22)19-13-5-3-4-12-18/h6-11,19H,3-5,12-13,18H2,1-2H3
- InChIKey
- MLEBFEHOJICQQS-UHFFFAOYSA-N
- SMILES
- CN(C)c1cccc2c(cccc12)S(=O)(=O)NCCCCCN
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
Warning
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, 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
Regulatory Information1-Naphthalenesulfonamide, N-(5-aminopentyl)-5-(dimethylamino)-: Does not have an individual approval but may be used under an appropriate group standard
Hazard Classes and CategoriesSkin Irrit. 2 (100%)
安全データ
- F
- 10-23
- wgk
- 3
- risk_code
- 36/37/38
- hazard_code
- Xi
- safety_code
- 26-36
- Hazard Classifications
- Eye Irrit. 2Skin Irrit. 2STOT SE 3
- ストレージクラス
- 11 - Combustible Solids
化学と産業
薬理情報
MeSH Pharmacological Classification
Substances that inhibit or prevent the proliferation of NEOPLASMS.
Compounds or agents that combine with an enzyme in such a manner as to prevent the normal substrate-enzyme combination and the catalytic reaction.
Chemicals that emit light after excitation by light. The wave length of the emitted light is usually longer than that of the incident light. Fluorochromes are substances that cause fluorescence in other substances, i.e., dyes used to mark or label other compounds with fluorescent tags.
Agents that suppress immune function by one of several mechanisms of action. Classical cytotoxic immunosuppressants act by inhibiting DNA synthesis. Others may act through activation of T-CELLS or by inhibiting the activation of HELPER CELLS. While immunosuppression has been brought about in the past primarily to prevent rejection of transplanted organs, new applications involving mediation of the effects of INTERLEUKINS and other CYTOKINES are emerging.
応用分野
説明Monodansylcadaverine (MDC) is a fluorescent marker for autophagic vacuoles. It is an autofluorescent substance incorporated into multilamellar bodies by both an ion trapping mechanism and interaction with membrane lipids, exhibiting a Stokes shift and increased relative fluorescence in hydrophobic environments. MDC selectively accumulates in PaTu 8902 subcellular fractions containing the lysosomal enzymes acid phosphatase and cathepsin D, but not those containing the rough and smooth endoplasmic reticulum markers TRAM and cytochrome P450, respectively.
使用Dansylcadaverine is a fluorescent amine probe, which is believed to directly inhibit vesicular transport. Studies indicate that Dansylcadaverine can act as a marker used to study autophagy in the cytoplasm and vacuoles of plants and mammalian cells.
サプライヤー66 社
苏州道澜生物医药科技有限公司15952404857 · [email protected]
上海阿拉丁生化科技股份有限公司
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