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CHEBI:126861 - 1-[[(2S,3R,4S)-4-(hydroxymethyl)-3-phenyl-2-azetidinyl]methyl]-3-propyl-1-(3-pyridinylmethyl)urea

ChEBI IDCHEBI:126861
ChEBI Name1-[[(2S,3R,4S)-4-(hydroxymethyl)-3-phenyl-2-azetidinyl]methyl]-3-propyl-1-(3-pyridinylmethyl)urea
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DownloadsMolfile
FormulaC21H28N4O2
Net Charge0
Average Mass368.481
Monoisotopic Mass368.22123
SMILESCCCNC(=O)N(Cc1cccnc1)C[C@H]1N[C@H](CO)[C@@H]1c1ccccc1
InChIInChI=1S/C21H28N4O2/c1-2-10-23-21(27)25(13-16-7-6-11-22-12-16)14-18-20(19(15-26)24-18)17-8-4-3-5-9-17/h3-9,11-12,18-20,24,26H,2,10,13-15H2,1H3,(H,23,27)/t18-,19-,20-/m1/s1
InChIKeyXOSRJLRYQHSFFK-VAMGGRTRSA-N
ChEBI Ontology
Outgoing Relation(s)
1-[[(2S,3R,4S)-4-(hydroxymethyl)-3-phenyl-2-azetidinyl]methyl]-3-propyl-1-(3-pyridinylmethyl)urea (CHEBI:126861) is a azetidines (CHEBI:38777)
1-[[(2S,3R,4S)-4-(hydroxymethyl)-3-phenyl-2-azetidinyl]methyl]-3-propyl-1-(3-pyridinylmethyl)urea (CHEBI:126861) is a benzenes (CHEBI:22712)
1-[[(2S,3R,4S)-4-(hydroxymethyl)-3-phenyl-2-azetidinyl]methyl]-3-propyl-1-(3-pyridinylmethyl)urea (CHEBI:126861) is a ring assembly (CHEBI:36820)
Manual XrefsDatabases
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