Identifiers

• Canonical SMILES:

  C[C@@H]1CC[C@@]23CCC(=O)[C@H]2[C@]1(C)[C@@H](C[C@](C)(CCn4cc(nn4)c5ccc(cc5)c6ccccc6)[C@@H](O)[C@@H]3C)OC(=O)CO

• IUPAC name:

  (3aS,4R,5S,6S,8R,9R,9aR,10R)-6-{2-[4-([1,1'-biphenyl]-4-yl)-1H-1,2,3-triazol-1-yl]ethyl}-5-hydroxy-4,6,9,10-tetramethyl-1-oxodecahydro-3a,9-propanocyclopenta[8]annulen-8-yl hydroxyacetate

• InChi:

  InChI=1S/C36H45N3O5/c1-23-14-16-36-17-15-29(41)32(36)35(23,4)30(44-31(42)22-40)20-34(3,33(43)24(36)2)18-19-39-21-28(37-38-39)27-12-10-26(11-13-27)25-8-6-5-7-9-25/h5-13,21,23-24,30,32-33,40,43H,14-20,22H2,1-4H3/t23-,24+,30-,32+,33+,34+,35+,36+/m1/s1

• InChiKey:

  MOLGLIZSBPUGSJ-VNYARFEYSA-N

• SMARTS:

  [#6]-[#6@@H]1-[#6]-[#6]-[#6@@]23-[#6]-[#6]-[#6](=[#8])-[#6@H]-2-[#6@]-1(-[#6])-[#6@@H](-[#6]-[#6@](-[#6])(-[#6]-[#6]-[#7]1:[#6]:[#6](:[#7]:[#7]:1)-[#6]1:[#6]:[#6]:[#6](:[#6]:[#6]:1)-[#6]1:[#6]:[#6]:[#6]:[#6]:[#6]:1)-[#6@@H](-[#8])-[#6@@H]-3-[#6])-[#8]-[#6](=[#8])-[#6]-[#8]

Chemistry rules

External links

179075539 A1CQ8

RNA-SM complexes