Identifiers

• Canonical SMILES:

  C[C@@H]1[C@H]2[C@H](O)[C@H]3[C@H](N(C)C)C(=C(C(N)=O)C(=O)[C@@]3(O)C(=C2C(=O)c4c(O)cccc14)O)O

• IUPAC name:

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

• InChi:

  InChI=1S/C22H24N2O8/c1-7-8-5-4-6-9(25)11(8)16(26)12-10(7)17(27)14-15(24(2)3)18(28)13(21(23)31)20(30)22(14,32)19(12)29/h4-7,10,14-15,17,25,27-29,32H,1-3H3,(H2,23,31)/t7-,10+,14+,15-,17-,22-/m0/s1

• InChiKey:

  JBIWCJUYHHGXTC-AKNGSSGZSA-N

• SMARTS:

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

Chemistry rules

External links

DXT DB00254

RNA-SM complexes