CHEBI:44983 - 2-{11-[1-HYDROXY-2-(3-METHYL-BUTYLAMINO)-ETHYL] -6,9-DIOXO-2-OXA-7,10-DIAZA-BICYCLO[11.2.2]HEPTADECA- 1(16),13(17),14-TRIEN-8-YL}-ACETAMIDE

ChEBI IDCHEBI:44983
ChEBI Name2-{11-[1-HYDROXY-2-(3-METHYL-BUTYLAMINO)-ETHYL] -6,9-DIOXO-2-OXA-7,10-DIAZA-BICYCLO[11.2.2]HEPTADECA- 1(16),13(17),14-TRIEN-8-YL}-ACETAMIDE
Stars
DownloadsMolfile
FormulaC23H36N4O5
Net Charge0
Average Mass448.564
Monoisotopic Mass448.26857
SMILES[H]O[C@]([H])(C([H])([H])N([H])C([H])([H])C([H])([H])C([H])(C([H])([H])[H])C([H])([H])[H])[C@@]1([H])N([H])C(=O)[C@]([H])(C([H])([H])C(=O)N([H])[H])N([H])C(=O)C([H])([H])C([H])([H])C([H])([H])Oc2c([H])c([H])c(c([H])c2[H])C1([H])[H]
InChIInChI=1S/C23H36N4O5/c1-15(2)9-10-25-14-20(28)18-12-16-5-7-17(8-6-16)32-11-3-4-22(30)26-19(13-21(24)29)23(31)27-18/h5-8,15,18-20,25,28H,3-4,9-14H2,1-2H3,(H2,24,29)(H,26,30)(H,27,31)/t18-,19-,20+/m0/s1
InChIKeySCRDVDSVEKGWGQ-SLFFLAALSA-N
ChEBI Ontology
Outgoing Relation(s)
2-{11-[1-HYDROXY-2-(3-METHYL-BUTYLAMINO)-ETHYL] -6,9-DIOXO-2-OXA-7,10-DIAZA-BICYCLO[11.2.2]HEPTADECA- 1(16),13(17),14-TRIEN-8-YL}-ACETAMIDE (CHEBI:44983) is a unclassifieds (CHEBI:27189)
Synonyms  Source
2-{11-[1-HYDROXY-2-(3-METHYL-BUTYLAMINO)-ETHYL] -6,9-DIOXO-2-OXA-7,10-DIAZA-BICYCLO[11.2.2]HEPTADECA- 1(16),13(17),14-TRIEN-8-YL}-ACETAMIDEPDBeChem
2-[(8S,11S)-11-{(1R)-1-hydroxy-2-[(3-methylbutyl)amino]ethyl}-6,9-dioxo-2-oxa-7,10-diazabicyclo[11.2.2]heptadeca-1(15),13,16-trien-8-yl]acetamidePDBeChem
Manual XrefsDatabases
PI2PDBeChem