N-DesBoc docetaxel-d5

Compound Identifiers & Properties

PubChem CID

169437552

SMILES

[2H]C1=C(C(=C(C(=C1[2H])[2H])C(=O)O[C@H]2[C@H]3[C@@]([C@H](CC4C3(CO4)OC(=O)C)O)(C(=O)[C@@H](C5=C([C@H](CC2(C5(C)C)O)OC(=O)[C@@H](C(C6=CC=CC=C6)N)O)C)O)C)[2H])[2H]

Canonical SMILES

[2H]c1c([2H])c([2H])c(C(=O)O[C@H]2[C@@H]3C4(OC(C)=O)COC4C[C@H](O)[C@@]3(C)C(=O)[C@H](O)C3=C(C)[C@@H](OC(=O)[C@H](O)C(N)c4ccccc4)CC2(O)C3(C)C)c([2H])c1[2H]