2-[[(5S,6R,9R)-14-[[(2-fluoroanilino)-oxomethyl]amino]-5-methoxy-3,6,9-trimethyl-2-oxo-11-oxa-3,8-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-8-yl]methyl]benzoic acid (CHEBI:110783)

EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:110783 - 2-[[(5S,6R,9R)-14-[[(2-fluoroanilino)-oxomethyl]amino]-5-methoxy-3,6,9-trimethyl-2-oxo-11-oxa-3,8-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-8-yl]methyl]benzoic acid

Take structure to advanced search

ChEBI ID	CHEBI:110783
ChEBI Name	2-[[(5S,6R,9R)-14-[[(2-fluoroanilino)-oxomethyl]amino]-5-methoxy-3,6,9-trimethyl-2-oxo-11-oxa-3,8-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-8-yl]methyl]benzoic acid
Stars
Downloads	Molfile

Formula	C32H37FN4O6
Net Charge	0
Average Mass	592.668
Monoisotopic Mass	592.26971
SMILES	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3ccccc3F)cc2OC[C@@H](C)N(Cc2ccccc2C(=O)O)C[C@H]1C
InChI	InChI=1S/C32H37FN4O6/c1-20-16-37(17-22-9-5-6-10-24(22)31(39)40)21(2)19-43-28-15-23(34-32(41)35-27-12-8-7-11-26(27)33)13-14-25(28)30(38)36(3)18-29(20)42-4/h5-15,20-21,29H,16-19H2,1-4H3,(H,39,40)(H2,34,35,41)/t20-,21-,29-/m1/s1
InChIKey	UVCFUAKKGJETNH-GVNDJSPXSA-N

ChEBI Ontology

Outgoing Relation(s)
	2-[[(5S,6R,9R)-14-[[(2-fluoroanilino)-oxomethyl]amino]-5-methoxy-3,6,9-trimethyl-2-oxo-11-oxa-3,8-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-8-yl]methyl]benzoic acid (CHEBI:110783) is a azamacrocycle (CHEBI:52898)
	2-[[(5S,6R,9R)-14-[[(2-fluoroanilino)-oxomethyl]amino]-5-methoxy-3,6,9-trimethyl-2-oxo-11-oxa-3,8-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-8-yl]methyl]benzoic acid (CHEBI:110783) is a lactam (CHEBI:24995)

Manual Xrefs	Databases
LSM-22227	LINCS