CAS No. 114899-77-3

Molecular Formula: C29H34Cl2N6O2
Molecular Weight: 569.52526

Description:
Trabectedin is an antitumor drug.

• Molecular Weight: 761.84
• Molecular Formula: C39H43N3O11S

Purity: 98%

Canonical SMILES:
CC1=C(C(=C2C3C4C5C6=C(C(N4C(C(N3C)CC2=C1)O)COC(=O)C7(CS5)C8=CC(=C(C=C8CCN7)O)OC)C9=C(C(=C6OC(=O)C)C)OCO9)O)OC

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+/m1/s1

InChIKey: PKVRCIRHQMSYJX-UBSPEYCNSA-NSynonyms:
Ecteinascidin; Yondelis; Ecteinascidin 743; ET-743; ET743; ET 743

More details are to be found on supplier website