
| Chemical & Physical Properties | |
|---|---|
| CAS Number | 119673-08-4 |
| Catalog No. | 2A-9060055 |
| Chinese Name | 贝卡特林 |
| Synonyms | Becatecarin |
| Molecular Formula | C33H34Cl2N4O7 |
| Molecular Weight | 669.552 |
| Purity | 98 |
| Density | 1.6±0.1 g/cm3 |
| Boiling Point | 848.8±65.0 °C at 760 mmHg |
| Application | Becatecarin is a rebeccamycin analog with anti-tumor effects. Becatecarin inserts into DNA and inhibits the catalytic activity of topoisomerase I/II. |
| SMILES | CCN(CC)CCN1C(=O)c2c(c3c4cccc(Cl)c4n(C4OC(CO)C(OC)C(O)C4O)c3c3[nH]c4c(Cl)cccc4c23)C1=O |
| InChI | InChI=1S/C33H34Cl2N4O7/c1-4-37(5-2)12-13-38-31(43)22-20-15-8-6-10-17(34)24(15)36-25(20)27-21(23(22)32(38)44)16-9-7-11-18(35)26(16)39(27)33-29(42)28(41)30(45-3)19(14-40)46-33/h6-11,19,28-30,33,36,40-42H,4-5,12-14H2,1-3H3 |
| InChI Key | JSKFWUPVIZYJMR-UDOAKELVSA-N |
| Transport Info | Product name: Becatrin |
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