EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:102865 - N-[(2R,3R,6S)-6-[2-(cyclopropylmethylamino)-2-oxoethyl]-2-(hydroxymethyl)-3-oxanyl]cyclobutanecarboxamide

ChEBI IDCHEBI:102865
ChEBI NameN-[(2R,3R,6S)-6-[2-(cyclopropylmethylamino)-2-oxoethyl]-2-(hydroxymethyl)-3-oxanyl]cyclobutanecarboxamide
Stars
DownloadsMolfile
FormulaC17H28N2O4
Net Charge0
Average Mass324.421
Monoisotopic Mass324.20491
SMILESO=C(C[C@@H]1CC[C@@H](NC(=O)C2CCC2)[C@H](CO)O1)NCC1CC1
InChIInChI=1S/C17H28N2O4/c20-10-15-14(19-17(22)12-2-1-3-12)7-6-13(23-15)8-16(21)18-9-11-4-5-11/h11-15,20H,1-10H2,(H,18,21)(H,19,22)/t13-,14+,15-/m0/s1
InChIKeyMSNHHRRUCLPTHC-ZNMIVQPWSA-N
ChEBI Ontology
Outgoing Relation(s)
N-[(2R,3R,6S)-6-[2-(cyclopropylmethylamino)-2-oxoethyl]-2-(hydroxymethyl)-3-oxanyl]cyclobutanecarboxamide (CHEBI:102865) is a C-glycosyl compound (CHEBI:20857)
Manual XrefsDatabases
LSM-14211LINCS