2'-{[(5-carbamimidoylpyridin-2-yl)amino]methyl}-4'-ethenyl-4-[(2-methylpropyl)carbamoyl]biphenyl-2-carboxylic acid (CHEBI:49386)

EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:49386 - 2'-{[(5-carbamimidoylpyridin-2-yl)amino]methyl}-4'-ethenyl-4-[(2-methylpropyl)carbamoyl]biphenyl-2-carboxylic acid

Default Structure

Take structure to advanced search

ChEBI ID	CHEBI:49386
ChEBI Name	2'-{[(5-carbamimidoylpyridin-2-yl)amino]methyl}-4'-ethenyl-4-[(2-methylpropyl)carbamoyl]biphenyl-2-carboxylic acid
Stars
Downloads	Molfile

Formula	C27H29N5O3
Net Charge	0
Average Mass	471.561
Monoisotopic Mass	471.22704
SMILES	[H]/N=C(/c1c([H])nc(N([H])C([H])([H])c2c([H])c(C([H])=C([H])[H])c([H])c([H])c2-c2c([H])c([H])c(C(=O)N([H])C([H])([H])C([H])(C([H])([H])[H])C([H])([H])[H])c([H])c2C(=O)O[H])c([H])c1[H])N([H])[H]
InChI	InChI=1S/C27H29N5O3/c1-4-17-5-8-21(20(11-17)15-31-24-10-7-19(14-30-24)25(28)29)22-9-6-18(12-23(22)27(34)35)26(33)32-13-16(2)3/h4-12,14,16H,1,13,15H2,2-3H3,(H3,28,29)(H,30,31)(H,32,33)(H,34,35)
InChIKey	HHFWQMFTPDFWLM-UHFFFAOYSA-N

ChEBI Ontology

Outgoing Relation(s)
	2'-{[(5-carbamimidoylpyridin-2-yl)amino]methyl}-4'-ethenyl-4-[(2-methylpropyl)carbamoyl]biphenyl-2-carboxylic acid (CHEBI:49386) is a unclassifieds (CHEBI:27189)

Synonym	Source
2'-{[(5-carbamimidoylpyridin-2-yl)amino]methyl}-4'-ethenyl-4-[(2-methylpropyl)carbamoyl]biphenyl-2-carboxylic acid	PDBeChem

Manual Xrefs	Databases
24X	PDBeChem