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기본 정보
- CAS
130144-34-2- 표준 SMILES
CCc1c2c(nc3ccc(O)cc13)-c1cc3c(c(=O)n1C2)COC(=O)C3(O)CC- InChIKey
FJHBVJOVLFPMQE-UHFFFAOYSA-N- 분자식
- C22H20N2O5
- 평균 분자량
- 392.411 g/mol
- 단동위원소 질량
- 392.13722174
이름 및 식별자
- 우선 이름
- 4,11-Diethyl-4,9-dihydroxy-1H-pyrano[3',4':6,7]indolizino[1,2-b]quinoline-3,14(4H,12H)-dione
- IUPAC
- 4,11-Diethyl-4,9-dihydroxy-1H-pyrano[3',4':6,7]indolizino[1,2-b]quinoline-3,14(4H,12H)-dione
- 영어명
- 7-Ethyl-10-hydroxycamptothecin
- 분자식
- C22H20N2O5
- 분자량
- 392.41
이름 및 동의어
Camptothecin Impurity 217-Ethyl-10-hydroxycamptothecin(rac)-7-Ethyl-10-Hydroxy camptothecinrac-4,11-Diethyl-9-hydroxycamptothecin7-Ethyl-10-hydroxycamptothecin, racemic7-Ethyl-10-Hydroxycamptothecin7-Ethyl-10-Hydroxycamptothecin1H-Pyrano[3,4:6,7]indolizino[1,2-b]quinoline-3,14(4H,12H)-dione, 4,11-diethyl-4,9-dihydroxy-4,11-Diethyl-4,9-dihydroxy-1H-pyrano[3',4':6,7]indolizino[1,2-b]quinoline-3,14(4H,12H)-dione
데이터베이스 식별자
- CAS
130144-34-2- PubChem CID
- 4014291
- DTXSID
DTXSID70861089- ChEMBL
CHEMBL10206- ChEBI
CHEBI:94969- UNII
- A8E798PHC2
- Nikkaji
- J360.578G
물성
물리화학적 성질
- 끓는 점
- 810.3 · 810.3±65.0 °C(Predicted)
- 밀도
- 1.51 · 1.51
- 산도 계수 (pKa)
- 9.13 · 9.13±0.40(Predicted)
- InChI
- InChI=1S/C22H20N2O5/c1-3-12-13-7-11(25)5-6-17(13)23-19-14(12)9-24-18(19)8-16-15(20(24)26)10-29-21(27)22(16,28)4-2/h5-8,25,28H,3-4,9-10H2,1-2H3
- InChIKey
- FJHBVJOVLFPMQE-UHFFFAOYSA-N
- SMILES
- N1C2C(=CC(O)=CC=2)C(CC)=C2CN3C(C=12)=CC1C(CC)(O)C(=O)OCC=1C3=O
화학 및 산업
응용 분야
개요7-Ethyl-10-hydroxycamptothecin: a potent topoisomerase I inhibitor7-Ethyl-10-hydroxycamptothecin (SN-38), as a highly active topoisomerase (Topo) I inhibitor, is the active metabolic product of its prodrug irinotecan (CPT-11) commercially available as Camptosar. By combining with the Topo I-DNA covalent conjugate, the camptothecin analogue forms a ternary complex that blocks the repolymerization of the DNA strands during their replication, eventually leading to the cell apoptosis. Although SN-38 is about 100- to 1000-fold more potent than irinotecan, its clinical application is limited by its poor solubility and nonspecific toxicity[1].
공급사49 곳
北京华美互利生物化工010-56205725 · [email protected]
湖北万得化工有限公司15377098680 15377098680 · [email protected]
Shochem(Shanghai) Co.,Ltd86-21-50800795 · [email protected]
天津瑞德法莫科技有限公司13821803402 · [email protected]
河南闰霖化工有限公司+86-18738066252; +86-18738066252 · [email protected]
苏州市森菲达化工有限公司18796480002 18796480002 · [email protected]
陕西缔都化学有限公司029-029-81123119 17391733320 · [email protected]
湖南瑞威尔生物科技有限公司18627957289 18173226957 · [email protected]
江苏普乐司生物科技有限公司0513-66017706 18551496367 · [email protected]
上海瀚鸿科技股份有限公司
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