Identifiers

• Canonical SMILES:

  CN(C)[C@H]1[C@@H]2C[C@H]3C(=C(O)[C@]2(O)C(=O)C(=C1O)C(N)=O)C(=O)c4c(O)ccc(Cl)c4[C@@]3(C)O

• IUPAC name:

  (4S,4aS,5aS,6S,12aS)-7-chloro-4-(dimethylamino)-3,6,10,12,12a-pentahydroxy-6-methyl-1,11-dioxo-1,4,4a,5,5a,6,11,12a-octahydrotetracene-2-carboxamide

• InChi:

  InChI=1S/C22H23ClN2O8/c1-21(32)7-6-8-15(25(2)3)17(28)13(20(24)31)19(30)22(8,33)18(29)11(7)16(27)12-10(26)5-4-9(23)14(12)21/h4-5,7-8,15,26,28-29,32-33H,6H2,1-3H3,(H2,24,31)/t7-,8-,15-,21-,22-/m0/s1

• InChiKey:

  CYDMQBQPVICBEU-XRNKAMNCSA-N

• SMARTS:

  [#6]-[#7](-[#6])-[#6@H]1-[#6@@H]2-[#6]-[#6@H]3-[#6](=[#6](-[#8])-[#6@]-2(-[#8])-[#6](=[#8])-[#6](=[#6]-1-[#8])-[#6](-[#7])=[#8])-[#6](=[#8])-[#6]1:[#6](-[#8]):[#6]:[#6]:[#6](-[#17]):[#6]:1-[#6@@]-3(-[#6])-[#8]

Chemistry rules

External links

CTC DB09093

RNA-SM complexes