Product Information
Name:Nintedanib Demethyl-O-glucuronic Acid-d3
Controlled Product
Brand:TRC
Description:Applications Nintedanib Demethyl-O-glucuronic Acid-d3 is an isotopic analog of Nintedanib Demethyl-O-glucuronic Acid (N478295), a metabolite of the drug Nintedanib (N478290).References Sun, L., et al.: J. Med. Chem., 41, 2588 (1998); Xie, H., et al.: J. Med. Chem., 50, 4898 (2007); Hilberg, F., et al.: Cancer Res., 68, 4774 (2008); Roth, G., et al.: J. Med. Chem., 58, 1053 (2015)
Notice:Our products are intended for lab use only. For any other use, please contact us.
Chemical properties
Molecular weight:704.74
Formula:C36H36D3N5O10
Color/Form:Neat
InChI:InChI=1S/C36H39N5O10/c1-39-14-16-41(17-15-39)19-26(42)40(2)23-11-9-22(10-12-23)37-28(20-6-4-3-5-7-20)27-24-13-8-21(18-25(24)38-33(27)46)35(49)51-36-31(45)29(43)30(44)32(50-36)34(47)48/h3-13,18,29-32,36,38,43-46H,14-17,19H2,1-2H3,(H,47,48)/t29-,30-,31+,32-,36-/m0/s1/i1D3
InChI key:InChIKey=GZWDDOFYQDCRIQ-WQJDREQMSA-N
SMILES:[2H]C([2H])([2H])N1CCN(CC(=O)N(C)c2ccc(N/C(=C3\C(=O)Nc4cc(C(=O)O[C@@H]5O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]5O)ccc43)c3ccccc3)cc2)CC1
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