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,1-dimethyl-6-indolecarboxamide (CHEBI:112612)

EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:112612 - 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,1-dimethyl-6-indolecarboxamide

Take structure to advanced search

ChEBI ID	CHEBI:112612
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,1-dimethyl-6-indolecarboxamide
Stars
Downloads	Molfile

Formula	C26H36N6O4
Net Charge	0
Average Mass	496.612
Monoisotopic Mass	496.27980
SMILES	C[C@@H]1CN([C@H](C)CO)C(=O)CCCn2nncc2CO[C@@H]1CN(C)C(=O)c1ccc2ccn(C)c2c1
InChI	InChI=1S/C26H36N6O4/c1-18-14-31(19(2)16-33)25(34)6-5-10-32-22(13-27-28-32)17-36-24(18)15-30(4)26(35)21-8-7-20-9-11-29(3)23(20)12-21/h7-9,11-13,18-19,24,33H,5-6,10,14-17H2,1-4H3/t18-,19-,24-/m1/s1
InChIKey	KMYKLRXROVKHNJ-KHCICDEESA-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,1-dimethyl-6-indolecarboxamide (CHEBI:112612) 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,1-dimethyl-6-indolecarboxamide (CHEBI:112612) is a lactam (CHEBI:24995)

Manual Xrefs	Databases
LSM-24022	LINCS