EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:100465 - (2R,3R,3aS,9bS)-N-cyclobutyl-3-(hydroxymethyl)-6-oxo-1-(2-phenylethyl)-3,3a,4,9b-tetrahydro-2H-pyrrolo[2,3-a]indolizine-2-carboxamide

ChEBI IDCHEBI:100465
ChEBI Name(2R,3R,3aS,9bS)-N-cyclobutyl-3-(hydroxymethyl)-6-oxo-1-(2-phenylethyl)-3,3a,4,9b-tetrahydro-2H-pyrrolo[2,3-a]indolizine-2-carboxamide
Stars
DownloadsMolfile
FormulaC24H29N3O3
Net Charge0
Average Mass407.514
Monoisotopic Mass407.22089
SMILESO=C(NC1CCC1)[C@H]1[C@H](CO)[C@H]2Cn3c(cccc3=O)[C@H]2N1CCc1ccccc1
InChIInChI=1S/C24H29N3O3/c28-15-19-18-14-27-20(10-5-11-21(27)29)22(18)26(13-12-16-6-2-1-3-7-16)23(19)24(30)25-17-8-4-9-17/h1-3,5-7,10-11,17-19,22-23,28H,4,8-9,12-15H2,(H,25,30)/t18-,19-,22+,23-/m1/s1
InChIKeyTURNTDXZFQQILD-PJIZGREPSA-N
ChEBI Ontology
Outgoing Relation(s)
(2R,3R,3aS,9bS)-N-cyclobutyl-3-(hydroxymethyl)-6-oxo-1-(2-phenylethyl)-3,3a,4,9b-tetrahydro-2H-pyrrolo[2,3-a]indolizine-2-carboxamide (CHEBI:100465) is a amino acid amide (CHEBI:22475)
Manual XrefsDatabases
LSM-11839LINCS