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CHEBI:45324 - 4-AMINO-N-{4-[2-(2,6-DIMETHYL-PHENOXY)-ACETYLAMINO]-3-HYDROXY-1-ISOBUTYL-5-PHENYL-PENTYL}-BENZAMIDE

Default Structure
ChEBI IDCHEBI:45324
ChEBI Name4-AMINO-N-{4-[2-(2,6-DIMETHYL-PHENOXY)-ACETYLAMINO]-3-HYDROXY-1-ISOBUTYL-5-PHENYL-PENTYL}-BENZAMIDE
Stars
Last Modified16 May 2008
DownloadsMolfile
FormulaC32H41N3O4
Net Charge0
Average Mass531.697
Monoisotopic Mass531.30971
SMILES[H]O[C@@]([H])(C([H])([H])[C@@]([H])(N([H])C(=O)c1c([H])c([H])c([H])c(N([H])[H])c1[H])C([H])([H])C([H])(C([H])([H])[H])C([H])([H])[H])[C@@]([H])(N([H])C(=O)C([H])([H])Oc1c(C([H])([H])[H])c([H])c([H])c([H])c1C([H])([H])[H])C([H])([H])c1c([H])c([H])c([H])c([H])c1[H]
InChIInChI=1S/C32H41N3O4/c1-21(2)16-27(34-32(38)25-14-9-15-26(33)18-25)19-29(36)28(17-24-12-6-5-7-13-24)35-30(37)20-39-31-22(3)10-8-11-23(31)4/h5-15,18,21,27-29,36H,16-17,19-20,33H2,1-4H3,(H,34,38)(H,35,37)/t27-,28-,29-/m0/s1
InChIKeyWQUBEIMCFHCJCO-AWCRTANDSA-N
ChEBI Ontology
Outgoing Relation(s)
4-AMINO-N-{4-[2-(2,6-DIMETHYL-PHENOXY)-ACETYLAMINO]-3-HYDROXY-1-ISOBUTYL-5-PHENYL-PENTYL}-BENZAMIDE (CHEBI:45324) is a unclassifieds (CHEBI:27189)
Synonyms  Source
3-amino-N-[(1S,3S,4S)-4-{[(2,6-dimethylphenoxy)acetyl]amino}-3-hydroxy-1-(2-methylpropyl)-5-phenylpentyl]benzamidePDBeChem
4-AMINO-N-{4-[2-(2,6-DIMETHYL-PHENOXY)-ACETYLAMINO]-3-HYDROXY-1-ISOBUTYL-5-PHENYL-PENTYL}-BENZAMIDEPDBeChem
Manual XrefsDatabases
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