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CHEBI:129540 - 1-[[(2R,3R,4S)-1-acetyl-3-[4-(1-cyclohexenyl)phenyl]-4-(hydroxymethyl)-2-azetidinyl]methyl]-3-propylurea

ChEBI IDCHEBI:129540
ChEBI Name1-[[(2R,3R,4S)-1-acetyl-3-[4-(1-cyclohexenyl)phenyl]-4-(hydroxymethyl)-2-azetidinyl]methyl]-3-propylurea
Stars
DownloadsMolfile
FormulaC23H33N3O3
Net Charge0
Average Mass399.535
Monoisotopic Mass399.25219
SMILESCCCNC(=O)NC[C@H]1[C@@H](c2ccc(C3=CCCCC3)cc2)[C@@H](CO)N1C(C)=O
InChIInChI=1S/C23H33N3O3/c1-3-13-24-23(29)25-14-20-22(21(15-27)26(20)16(2)28)19-11-9-18(10-12-19)17-7-5-4-6-8-17/h7,9-12,20-22,27H,3-6,8,13-15H2,1-2H3,(H2,24,25,29)/t20-,21+,22+/m0/s1
InChIKeyICLDRKSGEYCSHN-BHDDXSALSA-N
ChEBI Ontology
Outgoing Relation(s)
1-[[(2R,3R,4S)-1-acetyl-3-[4-(1-cyclohexenyl)phenyl]-4-(hydroxymethyl)-2-azetidinyl]methyl]-3-propylurea (CHEBI:129540) is a azetidines (CHEBI:38777)
1-[[(2R,3R,4S)-1-acetyl-3-[4-(1-cyclohexenyl)phenyl]-4-(hydroxymethyl)-2-azetidinyl]methyl]-3-propylurea (CHEBI:129540) is a benzenes (CHEBI:22712)
1-[[(2R,3R,4S)-1-acetyl-3-[4-(1-cyclohexenyl)phenyl]-4-(hydroxymethyl)-2-azetidinyl]methyl]-3-propylurea (CHEBI:129540) is a ring assembly (CHEBI:36820)
Manual XrefsDatabases
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