EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:122415 - 1-[(2S,3R,6S)-2-(hydroxymethyl)-6-[2-(4-methyl-1-piperazinyl)-2-oxoethyl]-3-oxanyl]-3-propylurea

ChEBI IDCHEBI:122415
ChEBI Name1-[(2S,3R,6S)-2-(hydroxymethyl)-6-[2-(4-methyl-1-piperazinyl)-2-oxoethyl]-3-oxanyl]-3-propylurea
Stars
DownloadsMolfile
FormulaC17H32N4O4
Net Charge0
Average Mass356.467
Monoisotopic Mass356.24236
SMILESCCCNC(=O)N[C@@H]1CC[C@@H](CC(=O)N2CCN(C)CC2)O[C@@H]1CO
InChIInChI=1S/C17H32N4O4/c1-3-6-18-17(24)19-14-5-4-13(25-15(14)12-22)11-16(23)21-9-7-20(2)8-10-21/h13-15,22H,3-12H2,1-2H3,(H2,18,19,24)/t13-,14+,15+/m0/s1
InChIKeyXCSADXMQLTVTGS-RRFJBIMHSA-N
ChEBI Ontology
Outgoing Relation(s)
1-[(2S,3R,6S)-2-(hydroxymethyl)-6-[2-(4-methyl-1-piperazinyl)-2-oxoethyl]-3-oxanyl]-3-propylurea (CHEBI:122415) is a C-glycosyl compound (CHEBI:20857)
Manual XrefsDatabases
LSM-33858LINCS