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Product details

名称

DRF-1042

分子类型

小分子

别名

(4S)-4-乙基-4-羟基-12-(2-羟基乙氧基)-1,12-二氢-14H-吡喃并[3',4':6,7]吲哚嗪并[1,2-b]喹啉-3,14(4H)-二酮

英文别名

(19S)-19-ethyl-19-hydroxy-12-(2-hydroxyethoxy)-17-oxa-3,13-diazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4,6,8,10,15(20)-heptaene-14,18-dione | 5-(2'-Hydroxyethoxy)-20(S)-camptothecin | DRF-1042 | AKOS040741671 | Q27258882 | MS-27012 | HY-1253

英文名称

DRF-1042

货号

D649596-5mg

包装规格

5mg

级别

Moligand™

浓度

≥98%

储存温度

避光,-20°C储存,充氩

运输条件

超低温冰袋运输

敏感性

对湿度敏感，对光线敏感，对空气敏感

生化机理

DRF-1042 是一种喜树碱类似物，具有抑制 DNA 拓扑异构酶 I (DNA topoisomerase I) 的作用。DRF-1042 对一组人癌细胞株，包括多药耐药 (MDR)表型，显示出良好的抗癌活性。

CAS号

200619-13-2

分子式

C22H20N2O6

分子量

408.40 g/mol

PubChem编号

23631031

Isomeric SMILES

CC[C@@]1(C2=C(COC1=O)C(=O)N3C(C4=CC5=CC=CC=C5N=C4C3=C2)OCCO)O

IIUPAC Name

(19S)-19-ethyl-19-hydroxy-12-(2-hydroxyethoxy)-17-oxa-3,13-diazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4,6,8,10,15(20)-heptaene-14,18-dione

INCHI

1S/C22H20N2O6/c1-2-22(28)15-10-17-18-13(9-12-5-3-4-6-16(12)23-18)20(29-8-7-25)24(17)19(26)14(15)11-30-21(22)27/h3-6,9-10,20,25,28H,2,7-8,11H2,1H3/t20?,22-/m0/s1

InChi Key

XAKLYHGHEFMDAP-IAXKEJLGSA-N

Smiles

CCC1(C2=C(COC1=O)C(=O)N3C(C4=CC5=CC=CC=C5N=C4C3=C2)OCCO)O

PubChem CID

23631031

关联CAS

200619-13-2

MeSH Entry Terms

5-(2'-hydroxyethoxy)-20(S)-camptothecin;DRF-1042;DRF1042

溶解性

DMSO : 50 mg/mL (122.43 mM; Need ultrasonic)

氢键供体数Hydrogen Bond Donor Count

氢键受体数Hydrogen Bond Acceptor Count

可旋转键计数Rotatable Bond Count

精确质量Exact Mass

408.132 Da

单同位素质量Monoisotopic Mass

408.132 Da

拓扑极表面积Topological Polar Surface Area

109.000 Å²

重原子数Heavy Atom Count

形式电荷Formal Charge

复杂度Complexity

822.000

同位素原子数Isotope Atom Count

共价键合单元计数Covalently-Bonded Unit Count

XLogP3

0.300

Safety

「No Dangerous Attributes」

「No upstream and downstream information yet」

Technical Documents

「No technical documents」

Articles

「No related articles yet」

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