Trabectedin
Trabectedin (ecteinascidin-743, ET-743) is a marine-derived tetrahydroisoquinoline alkaloid that binds to the minor groove of DNA, distorting the DNA helix, stalling RNA polymerase II, and triggering nucleotide excision repair machinery to generate lethal double-strand breaks preferentially in actively transcribed genes. It is approved for unresectable soft tissue sarcoma and relapsed ovarian cancer (in combination with pegylated liposomal doxorubicin), and is under investigation for other malignancies. Its unique mechanism of action in transcription-coupled repair makes it active in tumors with deficient homologous recombination.
分子量
761.8000 g/mol
LogP
3.40
TPSA
194.00 Ų
Lipinski 五规则
不符合
治疗领域
Pharmacokinetics (PK)
Pharmacodynamics (PD)
二维结构
Cite this structure
Embed this structure
SMILES
COc1cc2c(cc1O)CCN[C@]21CS[C@@H]2c3c(OC(C)=O)c(C)c4c(c3[C@H](COC1=O)N1[C@@H]2[C@H]2c3c(cc(C)c(OC)c3O)C[C@@H]([C@@H]1O)N2C)OCO4
InChI
InChI=1S/C39H43N3O11S/c1-16-9-20-10-22-37(46)42-23-13-50-38(47)39(21-12-25(48-5)24(44)11-19(21)7-8-40-39)14-54-36(30(42)29(41(22)4)26(20)31(45)32(16)49-6)28-27(23)35-34(51-15-52-35)17(2)33(28)53-18(3)43/h9,11-12,22-23,29-30,36-37,40,44-46H,7-8,10,13-15H2,1-6H3/t22-,23-,29+,30+,36+,37-,39+/m0/s1
Molecular Formula
C39H43N3O11S
HBD / HBA
4 / 15
可旋转键数
4
重原子数
54
No targets recorded
Target interaction data is not yet available for this drug.
No interactions recorded
Drug interaction data is not yet available for this compound.
No side effects recorded
Side effect data is not yet available for this drug.
常见问题
Trabectedin (ecteinascidin-743, ET-743) is a marine-derived tetrahydroisoquinoline alkaloid that binds to the minor groove of DNA, distorting the DNA helix, stalling RNA polymerase II, and triggering nucleotide excision repair machinery to generate lethal double-strand breaks preferentially in actively transcribed genes. It is approved for unresectable soft tissue sarcoma and relapsed ovarian cancer (in combination with pegylated liposomal doxorubicin), and is under investigation for other malignancies. Its unique mechanism of action in transcription-coupled repair makes it active in tumors with deficient …
Yes, Trabectedin is an approved drug. It has reached clinical phase 4. It is classified as a Small molecule.
References & Data Sources
- ChEMBL — European Bioinformatics Institute (EBI). CHEMBL450449. Open-access bioactivity database.
- PubChem — National Center for Biotechnology Information (NCBI). CID 108150. Chemical information database.
Data aggregated from publicly available pharmacological databases. Last updated 2026-03-28.
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