产品名称

英文名称：Temsirolimus (CCI-779, NSC 683864)

同义词

Temsirolimus、Torisel、CCI-779、162635-04-3、624KN6GM2T、DTXSID2040945、UNII-624KN6GM2T、WAY-CCI 779、CHEMBL1201182、DTXCID0020945、HSDB 7931、Cci 779、Rapamycin 42-(2,2-bis(hydroxymethyl)propionate)、NCGC00167518-01、Rapamycin, 42-(3-hydroxy-2-(hydroxymethyl)-2-methyl、西罗莫司脂化物、雷帕霉素42-[3-羟基-2-(羟甲基)-2-甲基丙酸酯]

产品性质

CAS编号：162635-04-3

分子式：C56H87NO16

分子量：1030.29

PubChem编号：6918289

别名：西罗莫司脂化物|雷帕霉素42-[3-羟基-2-(羟甲基)-2-甲基丙酸酯]

英文别名：Temsirolimus|Torisel|CCI-779|162635-04-3|624KN6GM2T|DTXSID2040945|UNII-624KN6GM2T|WAY-CCI 779|CHEMBL1201182|DTXCID0020945|HSDB 7931|Cci 779|Rapamycin 42-(2,2-bis(hydroxymethyl)propionate)|NCGC00167518-01|Rapamycin, 42-(3-hydroxy-2-(hydroxymethyl)-2-methyl

规格或纯度：≥98%

英文名称：Temsirolimus (CCI-779, NSC 683864)

生化机理：Temsirolimus (also known as CCI-779) is a recently developed mTOR inhibitor. with improved aqueous solubility and more favorable pharmaceutical properties compared with the parent compound rapamycin.Selective mTORC1 complex inhibitor (IC 50 = 1.76 µM). Water-soluble rapamycin pro-drug. Rapidly converts to rapamycin in vivo . Inhibits proliferation and angiogenesis and induces apoptosis and autophagy in vivo .

储存温度：-20°C储存

运输条件：超低温冰袋运输

备注：如果有可能，您尽量在使用的当天配置溶液，并在当天使用完它。但是，如果您需要预先配制储备溶液，我们建议您将溶液等份保存在-20°C的密封小瓶中。通常，它们最多可以使用一个月。在使用前和打开样品瓶之前，我们建议您让您的产品在室温下平衡至少1小时。需要更多关于溶解度，用法和处理的建议吗？请访问我们的常见问题（FAQ）页面以获取更多详细信息。

产品介绍：Temsirolimus (CCI-779) 抑制mTOR激酶活性 IC50值为1.76 ± 0.15 μM。A potent inhibitor of FRAP (mTOR) kinase activityTemsirolimus (CCI-779) directly inhibits mTOR kinase activity with IC50 values of 1.76 ± 0.15 μM.A potent inhibitor of FRAP (mTOR) kinase activityapplicationTemsirolimus is used as a rapamycin derivative with anti-cancer activity that inhibits mTOR. Temsirolimus is an antiproliferative and antiangiogenic, the first-in-class mTOR inhibitor approved for the treatment of patients with advanced poor prognosis renal cell carcinoma.

ALogP：5.6

IUPAC Name：[(1R,2R,4S)-4-[(2R)-2-[(1R,9S,12S,15R,16E,18R,19R,21R,23S,24E,26E,28E,30S,32S,35R)-1,18-dihydroxy-19,30-dimethoxy-15,17,21,23,29,35-hexamethyl-2,3,10,14,20-pentaoxo-11,36-dioxa-4-azatricyclo[30.3.1.04,9]hexatriaconta-16,24,26,28-tetraen-12-yl]propyl]-2-methoxycyclohexyl] 3-hydroxy-2-(hydroxymethyl)-2-methylpropanoate

INCHI：InChI=1S/C56H87NO16/c1-33-17-13-12-14-18-34(2)45(68-9)29-41-22-20-39(7)56(67,73-41)51(63)52(64)57-24-16-15-19-42(57)53(65)71-46(30-43(60)35(3)26-38(6)49(62)50(70-11)48(61)37(5)25-33)36(4)27-40-21-23-44(47(28-40)69-10)72-54(66)55(8,31-58)32-59/h12-14,17-18,26,33,35-37,39-42,44-47,49-50,58-59,62,67H,15-16,19-25,27-32H2,1-11H3/b14-12+,17-13+,34-18+,38-26+/t33-,35-,36-,37-,39-,40+,41+,42+,44-,45+,46+,47-,49-,50+,56-/m1/s1

InChi Key：CBPNZQVSJQDFBE-FUXHJELOSA-N

Canonical SMILES：CC1CCC2CC(C(=CC=CC=CC(CC(C(=O)C(C(C(=CC(C(=O)CC(OC(=O)C3CCCCN3C(=O)C(=O)C1(O2)O)C(C)CC4CCC(C(C4)OC)OC(=O)C(C)(CO)CO)C)C)O)OC)C)C)C)OC

Isomeric SMILES：C[C@@H]1CC[C@H]2C[C@@H](/C(=C/C=C/C=C/[C@H](C[C@H](C(=O)[C@@H]([C@@H](/C(=C/[C@H](C(=O)C[C@H](OC(=O)[C@@H]3CCCCN3C(=O)C(=O)[C@@]1(O2)O)[C@H](C)C[C@@H]4CC[C@H]([C@@H](C4)OC)OC(=O)C(C)(CO)CO)C)/C)O)OC)C)C)/C)OC

WGK Germany：3

PubChem CID：6918289

CAS Registry No.：162635-04-3

ChEMBL Ligand：CHEMBL1201182

Wikipedia：Temsirolimus

DrugBank Ligand：DB06287

PEP：temsirolimus

DrugCentral Ligand：4161

RCSB PDB Ligand：A4I

溶解性：DMSO ≥200mg/mL Water ≥1.2mg/mL Ethanol ≥200mg/mL

象形图：

信号词：Danger

危险声明：H410 Very toxic to aquatic life with long lasting effectsH360 May damage fertility or the unborn child

预防措施声明：P273,P280,P405,P501,P391,P203,P318

个人防护装备：dust mask type N95 (US), Eyeshields, Faceshields, Gloves

产品包装