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Nintedanib Demethyl-O-glucuronic Acid, TRC

Artikelnummer. 30471811
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Mængde:
0.5 mg
Pakningsstørrelse:
0.5mg
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Artikelnummer. 30471811 Leverandør Toronto Research Chemicals Leverandørnr. TRCN4782950.5MG

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Specifica

Kemisk navn eller materiale Nintedanib Demethyl-O-glucuronic Acid
CAS 1352789-50-4
Molekylær formel C36 H39 N5 O10
Mængde 0.5 mg
Synonym Nintedanib Metabolite M2
InChI formel 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/h3-13,18,29-32,36-37,43-45H,14-17,19H2,1-2H3,(H,38,46)(H,47,48)/b28-27-/t29-,30-,31+,32-,36+/m1/s1
SMIL CN(C(=O)CN1CCN(C)CC1)c2ccc(N\C(=C\3/C(=O)Nc4cc(ccc34)C(=O)O[C@@H]5O[C@H]([C@H](O)[C@@H](O)[C@@H]5O)C(=O)O)\c6ccccc6)cc2
IUPAC navn (2R,3R,4R,5S,6S)-3,4,5-trihydroxy-6-[(3Z)-3-[[4-[methyl-[2-(4-methylpiperazin-1-yl)acetyl]amino]anilino]-phenyl-methylene]-2-oxo-indoline-6-carbonyl]oxy-tetrahydropyran-2-carboxylic acid
Molekylvægt (g/mol) 701.72
Formel vægt 701.2697
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