CAS Number
Molecular Formula
C41H44N4O10S
Product format
Neat
Molecular Weight
784.88
API Family
Synonyms
Lurbinectedin; 497871-47-3; PM01183; Tryptamicidin; Zepzelca; zepsyre; PM-01183; lurbinectedina; lurbinectedine; 2CN60TN6ZS; PM-1183; PM 01183; PM1183; DTXSID30198065; [(1R, 2R, 3R, 11S, 12S, 14R, 26R)-5, 12-dihydroxy-6, 6'-dimethoxy-7, 21, 30-trimethyl-27-oxospiro[17, 19, 28-trioxa-24-thia-13, 30-diazaheptacyclo[12.9.6.13, 11.02, 13.04, 9.015, 23.016, 20]triaconta-4(9), 5, 7, 15, 20, 22-hexaene-26, 1'-2, 3, 4, 9-tetrahydropyrido[3, 4-b]indole]-22-yl] acetate; lurbinectedinum; ((1R, 2R, 3R, 11S, 12S, 14R, 26R)-5, 12-dihydroxy-6, 6'-dimethoxy-7, 21, 30-trimethyl-27-oxospiro(17, 19, 28-trioxa-24-thia-13, 30-diazaheptacyclo(12.9.6.13, 11.02, 13.04, 9.015, 23.016, 20)triaconta-4(9), 5, 7, 15, 20, 22-hexaene-26, 1'-2, 3, 4, 9-tetrahydropyrido(3 and 4-b)indole)-22-yl) acetate; RefChem:56744; DTXCID60120556; Lurbinectedin [INN]
Iupac Name
[(1R, 2R, 3R, 11S, 12S, 14R, 26R)-5, 12-dihydroxy-6, 6'-dimethoxy-7, 21, 30-trimethyl-27-oxospiro[17, 19, 28-trioxa-24-thia-13, 30-diazaheptacyclo[12.9.6.13, 11.02, 13.04, 9.015, 23.016, 20]triaconta-4(9), 5, 7, 15, 20, 22-hexaene-26, 1'-2, 3, 4, 9-tetrahydropyrido[3 and 4-b]indole]-22-yl] acetate
InChI
InChI=1S/C41H44N4O10S/c1-17-11-20-12-25-39(48)45-26-14-52-40(49)41(38-22(9-10-42-41)23-13-21(50-5)7-8-24(23)43-38)15-56-37(31(45)30(44(25)4)27(20)32(47)33(17)51-6)29-28(26)36-35(53-16-54-36)18(2)34(29)55-19(3)46/h7-8,11,13,25-26,30-31,37,39,42-43,47-48H,9-10,12,14-16H2,1-6H3/t25-,26-,30+,31+,37+,39-,41+/m0/s1
