N-[(3R,9R,10R)-9-[[cyclopropylmethyl(methyl)amino]methyl]-12-[(2S)-1-hydroxypropan-2-yl]-3,10-dimethyl-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]-4-pyridinecarboxamide (CHEBI:103676)

EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:103676 - N-[(3R,9R,10R)-9-[[cyclopropylmethyl(methyl)amino]methyl]-12-[(2S)-1-hydroxypropan-2-yl]-3,10-dimethyl-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]-4-pyridinecarboxamide

Take structure to advanced search

ChEBI ID	CHEBI:103676
ChEBI Name	N-[(3R,9R,10R)-9-[[cyclopropylmethyl(methyl)amino]methyl]-12-[(2S)-1-hydroxypropan-2-yl]-3,10-dimethyl-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]-4-pyridinecarboxamide
Stars
Downloads	Molfile

Formula	C32H46N4O5
Net Charge	0
Average Mass	566.743
Monoisotopic Mass	566.34682
SMILES	C[C@@H]1CCCCO[C@@H](CN(C)CC2CC2)[C@H](C)CN([C@@H](C)CO)C(=O)c2cc(NC(=O)c3ccncc3)ccc2O1
InChI	InChI=1S/C32H46N4O5/c1-22-18-36(23(2)21-37)32(39)28-17-27(34-31(38)26-12-14-33-15-13-26)10-11-29(28)41-24(3)7-5-6-16-40-30(22)20-35(4)19-25-8-9-25/h10-15,17,22-25,30,37H,5-9,16,18-21H2,1-4H3,(H,34,38)/t22-,23+,24-,30+/m1/s1
InChIKey	YDCDOYMHDVYTIM-IFVFNEAISA-N

ChEBI Ontology

Outgoing Relation(s)
	N-[(3R,9R,10R)-9-[[cyclopropylmethyl(methyl)amino]methyl]-12-[(2S)-1-hydroxypropan-2-yl]-3,10-dimethyl-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]-4-pyridinecarboxamide (CHEBI:103676) is a azamacrocycle (CHEBI:52898)
	N-[(3R,9R,10R)-9-[[cyclopropylmethyl(methyl)amino]methyl]-12-[(2S)-1-hydroxypropan-2-yl]-3,10-dimethyl-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]-4-pyridinecarboxamide (CHEBI:103676) is a lactam (CHEBI:24995)

Manual Xrefs	Databases
LSM-15020	LINCS