EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:112128 - N-[(4R,7R,8R)-5-[cyclopropyl(oxo)methyl]-8-methoxy-4,7,10-trimethyl-11-oxo-2-oxa-5,10-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]-2-pyrazinecarboxamide

ChEBI IDCHEBI:112128
ChEBI NameN-[(4R,7R,8R)-5-[cyclopropyl(oxo)methyl]-8-methoxy-4,7,10-trimethyl-11-oxo-2-oxa-5,10-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]-2-pyrazinecarboxamide
Stars
DownloadsMolfile
FormulaC26H33N5O5
Net Charge0
Average Mass495.580
Monoisotopic Mass495.24817
SMILESCO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3cnccn3)ccc2OC[C@@H](C)N(C(=O)C2CC2)C[C@H]1C
InChIInChI=1S/C26H33N5O5/c1-16-13-31(25(33)18-5-6-18)17(2)15-36-22-8-7-19(29-24(32)21-12-27-9-10-28-21)11-20(22)26(34)30(3)14-23(16)35-4/h7-12,16-18,23H,5-6,13-15H2,1-4H3,(H,29,32)/t16-,17-,23+/m1/s1
InChIKeyXITJMNWLTPOVPR-QZMQVMSPSA-N
ChEBI Ontology
Outgoing Relation(s)
N-[(4R,7R,8R)-5-[cyclopropyl(oxo)methyl]-8-methoxy-4,7,10-trimethyl-11-oxo-2-oxa-5,10-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]-2-pyrazinecarboxamide (CHEBI:112128) is a azamacrocycle (CHEBI:52898)
N-[(4R,7R,8R)-5-[cyclopropyl(oxo)methyl]-8-methoxy-4,7,10-trimethyl-11-oxo-2-oxa-5,10-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]-2-pyrazinecarboxamide (CHEBI:112128) is a lactam (CHEBI:24995)
Manual XrefsDatabases
LSM-23540LINCS