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CHEBI:98576 - 1-(2-fluorophenyl)-3-[(2S,3S,6S)-2-(hydroxymethyl)-6-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]-3,6-dihydro-2H-pyran-3-yl]urea

ChEBI IDCHEBI:98576
ChEBI Name1-(2-fluorophenyl)-3-[(2S,3S,6S)-2-(hydroxymethyl)-6-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]-3,6-dihydro-2H-pyran-3-yl]urea
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DownloadsMolfile
FormulaC20H27FN4O4
Net Charge0
Average Mass406.458
Monoisotopic Mass406.20163
SMILESCN1CCN(C(=O)C[C@H]2C=C[C@H](NC(=O)Nc3ccccc3F)[C@@H](CO)O2)CC1
InChIInChI=1S/C20H27FN4O4/c1-24-8-10-25(11-9-24)19(27)12-14-6-7-17(18(13-26)29-14)23-20(28)22-16-5-3-2-4-15(16)21/h2-7,14,17-18,26H,8-13H2,1H3,(H2,22,23,28)/t14-,17+,18-/m1/s1
InChIKeyZHYLMLAAZLDJNG-FHLIZLRMSA-N
ChEBI Ontology
Outgoing Relation(s)
1-(2-fluorophenyl)-3-[(2S,3S,6S)-2-(hydroxymethyl)-6-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]-3,6-dihydro-2H-pyran-3-yl]urea (CHEBI:98576) is a ureas (CHEBI:47857)
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