N-[[(8R,9S)-6-[(2R)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,14,15-tetrazabicyclo[10.3.0]pentadeca-12,14-dien-9-yl]methyl]-N-methyl-2-phenylacetamide (CHEBI:96868)

EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:96868 - N-[[(8R,9S)-6-[(2R)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,14,15-tetrazabicyclo[10.3.0]pentadeca-12,14-dien-9-yl]methyl]-N-methyl-2-phenylacetamide

Take structure to advanced search

ChEBI ID	CHEBI:96868
ChEBI Name	N-[[(8R,9S)-6-[(2R)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,14,15-tetrazabicyclo[10.3.0]pentadeca-12,14-dien-9-yl]methyl]-N-methyl-2-phenylacetamide
Stars
Downloads	Molfile

Formula	C24H35N5O4
Net Charge	0
Average Mass	457.575
Monoisotopic Mass	457.26890
SMILES	C[C@@H]1CN([C@H](C)CO)C(=O)CCCn2nncc2CO[C@@H]1CN(C)C(=O)Cc1ccccc1
InChI	InChI=1S/C24H35N5O4/c1-18-14-28(19(2)16-30)23(31)10-7-11-29-21(13-25-26-29)17-33-22(18)15-27(3)24(32)12-20-8-5-4-6-9-20/h4-6,8-9,13,18-19,22,30H,7,10-12,14-17H2,1-3H3/t18-,19-,22-/m1/s1
InChIKey	MESWQEBVROHANN-WOIUINJBSA-N

ChEBI Ontology

Outgoing Relation(s)
	N-[[(8R,9S)-6-[(2R)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,14,15-tetrazabicyclo[10.3.0]pentadeca-12,14-dien-9-yl]methyl]-N-methyl-2-phenylacetamide (CHEBI:96868) is a azamacrocycle (CHEBI:52898)
	N-[[(8R,9S)-6-[(2R)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,14,15-tetrazabicyclo[10.3.0]pentadeca-12,14-dien-9-yl]methyl]-N-methyl-2-phenylacetamide (CHEBI:96868) is a lactam (CHEBI:24995)

Manual Xrefs	Databases
LSM-8247	LINCS