Name: TLC 388
Rating: 5 (10 reviews)

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HIT ID:HIT212713794
Cas No:1432468-79-5
常用名:TLC 388
别名:TLC-388, TLC388
IUPAC:(19S)-8-[(dimethylamino)methyl]-19-ethyl-7-hydroxy-14,18-dioxo-17-oxa-3,13-diazapentacyclo[11.8.0.0^{2,11}.0^{4,9}.0^{15,20}]henicosa-1(21),2,4,6,8,10,15(20)-heptaen-19-yl 2-{[(2,4,5,7-tetranitro-9H-fluoren-9-ylidene)amino]oxy}propanoate
IUPAC:(19S)-8-[(dimethylamino)methyl]-19-ethyl-7-hydroxy-14,18-dioxo-17-oxa-3,13-diazapentacyclo[11.8.0.0^{2,11}.0^{4,9}.0^{15,20}]henicosa-1(21),2,4,6,8,10,15(20)-heptaen-19-yl 2-{[(2,4,5,7-tetranitro-9H-fluoren-9-ylidene)amino]oxy}propanoate
InChI key:JCCCLGDYMMTBPM-HXDHBHDHSA-N

分子式:C39H30N8O15
分子量:850.71
氢键供体数 (HBD):1
氢键受体数 (HBA):16
LogP:3.608916
SMILES:[#6]-[#6][C@@]1([#8]-[#6](=O)-[#6](-[#6])-[#8]\[#7]=[#6]-2/c3cc(cc(c3-c3c-2cc(cc3-[#7+](-[#8-])=O)-[#7+](-[#8-])=O)-[#7+](-[#8-])=O)-[#7+](-[#8-])=O)[#6](=O)-[#8]-[#6]-c2c1cc1-c3nc4ccc(-[#8])c(-[#6]-[#7](-[#6])-[#6])c4cc3-[#6]-n1c2=O
SMILES:[#6]-[#6][C@@]1([#8]-[#6](=O)-[#6](-[#6])-[#8]\[#7]=[#6]-2/c3cc(cc(c3-c3c-2cc(cc3-[#7+](-[#8-])=O)-[#7+](-[#8-])=O)-[#7+](-[#8-])=O)-[#7+](-[#8-])=O)[#6](=O)-[#8]-[#6]-c2c1cc1-c3nc4ccc(-[#8])c(-[#6]-[#7](-[#6])-[#6])c4cc3-[#6]-n1c2=O

TLC 388, a DNA topoisomerase I inhibitor, is used potentially for the treatment of Renal carcinoma and Hepatocellular carcinoma

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