(S)-Selisistat

COA

级别和纯度:

≥98%

CAS编号: 848193-68-0
分子式: C₁₃H₁₃ClN₂O
分子量: 248.71
PubChem编号: 707029

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货号 (SKU)	包装规格	是否现货
S651576-1mg	1mg	期货
S651576-5mg	5mg	期货
S651576-10mg	10mg	期货

查看相关系列

Cell Cycle (7376) Cell Cycle/DNA Damage (2603) Histone Modification (3105) Sirtuin (94) 表观遗传学 (1497)

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基本描述

别名	(S)-塞利司他
英文别名	HY-15452A \| Selisistat, (S)- \| BRD-K76964878-001-01-8 \| BDBM50309833 \| MS-23523 \| EX-527 (S-enantiomer) \| EX-527 (S) \| EX-527(S) \| 4bvb \| Selisistat S-enantiomer(EX-527 S-enantiomer) \| (S)-6-chloro-2,3,4,9-tetrahydro-1H-carbazole-1-carboxamide \| EX-527 S-
规格或纯度	≥98%
英文名称	(S)-Selisistat
生化机理	(S)-塞利司他（(S)-EX-527）是一种强效的选择性 SIRT1 抑制剂，其 IC 50 为 98 nM。
储存温度	-20°C储存
运输条件	超低温冰袋运输
作用类型	抑制剂
产品介绍	(S)-Selisistat ((S)-EX-527) is a potent and selective SIRT1 inhibitor, with an IC 50 of 98 nM. In Vitro (S)-Selisistat is an inhibitor of SIRT1 enzymatic activity (IC 50 , 98 nM), identified in a high-throughput screen using bacterially expressed human SIRT1. (S)-Selisistat inhibits SIRT1 in a concentration-dependent manner with an IC 50 of 38 nM, in agreement with the activity on bacterially expressed SIRT1. (S)-Selisistat has much lower potency against SIRT2 (IC 50 , 19.6 μM) or SIRT3 (IC 50 , 48.7 μM) but does not inhibit class I/II HDAC activity at concentrations up to 100 μM. (S)-Selisistat exerts an inhibitory effect on SIRT1 activity without affecting SIRT1 expression on both mRNA and protein levels. MCE has not independently confirmed the accuracy of these methods. They are for reference only. In Vivo (S)-Selisistat abolishes Resveratrol (RSV)-induced attenuation of microvascular inflammation in ob/ob septic mice. Finally, ob/ob mice in Sepsis+RSV group has significantly increased 7-day survival vs. Sepsis+Vehicle group. MCE has not independently confirmed the accuracy of these methods. They are for reference only. Form:Solid IC50& Target:SIRT1 98 nM (IC 50 )
纯度	≥98%

关联靶点（人）

SIRT1 Tchem NAD 依赖性蛋白去乙酰化酶 sirtuin-1(NAD-dependent protein deacetylase sirtuin-1) (1 活性数据)

点击查看靶蛋白信息： SIRT1

活性类型	活性值-log(M)	作用机制	期刊	参考文献(PubMed IDs)

SIRT2 Tchem NAD-dependent deacetylase sirtuin 2 (3979 活性数据)

点击查看靶蛋白信息： SIRT2

活性类型	Relation	Activity value	Units	Action Type	期刊	PubMed Id	doi	Assay Aladdin ID

SIRT1 Tchem NAD-dependent deacetylase sirtuin 1 (3505 活性数据)

点击查看靶蛋白信息： SIRT1

活性类型	Relation	Activity value	Units	Action Type	期刊	PubMed Id	doi	Assay Aladdin ID

关联靶点（其它种属）

Caenorhabditis elegans (1055 活性数据)

点击查看此靶标相关信息

活性类型	Relation	Activity value	Units	Action Type	期刊	PubMed Id	doi	Assay Aladdin ID

rep Replicase polyprotein 1ab (378 活性数据)

点击查看靶蛋白信息： rep

活性类型	Relation	Activity value	Units	Action Type	期刊	PubMed Id	doi	Assay Aladdin ID

SARS-CoV-2 (38078 活性数据)

点击查看此靶标相关信息

活性类型	Relation	Activity value	Units	Action Type	期刊	PubMed Id	doi	Assay Aladdin ID

作用机制

作用机制	Action Type	target ID	Target Name	Target Type	Target Organism	Binding Site Name	参考文献

名称和识别符

分子类型	小分子
IIUPAC Name	(1S)-6-chloro-2,3,4,9-tetrahydro-1H-carbazole-1-carboxamide
INCHI	1S/C13H13ClN2O/c14-7-4-5-11-10(6-7)8-2-1-3-9(13(15)17)12(8)16-11/h4-6,9,16H,1-3H2,(H2,15,17)/t9-/m0/s1
InChi Key	FUZYTVDVLBBXDL-VIFPVBQESA-N
Smiles	C1CC(C2=C(C1)C3=C(N2)C=CC(=C3)Cl)C(=O)N
Isomeric SMILES	C1C[C@@H](C2=C(C1)C3=C(N2)C=CC(=C3)Cl)C(=O)N
关联CAS	848193-68-0
分子量	248.71
Reaxy-Rn	416178
Reaxys-RN link address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=416178&ln=

化学和物理性质

溶解性	DMSO : ≥ 100 mg/mL (402.07 mM)
分子量	248.710 g/mol
XLogP3	2.500
氢键供体数Hydrogen Bond Donor Count	2
氢键受体数Hydrogen Bond Acceptor Count	1
可旋转键计数Rotatable Bond Count	1
精确质量Exact Mass	248.072 Da
单同位素质量Monoisotopic Mass	248.072 Da
拓扑极表面积Topological Polar Surface Area	58.900 Å²
重原子数Heavy Atom Count	17
形式电荷Formal Charge	0
复杂度Complexity	323.000
同位素原子数Isotope Atom Count	0
定义的原子立体中心计数Defined Atom Stereocenter Count	1
未定义的原子立体中心计数Undefined Atom Stereocenter Count	0
定义的键立体中心计数Defined Bond Stereocenter Count	0
未定义的键立体中心计数Undefined Bond Stereocenter Count	0
所有立体化学键的总数The total count of all stereochemical bonds	0
共价键合单元计数Covalently-Bonded Unit Count	1