EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:42705 - 1-((1R)-1-(HYDROXYMETHYL)-3-{6-[(5-PHENYLPENTANOYL)AMINO]-1H-INDOL-1-YL}PROPYL)-1H-IMIDAZOLE-4-CARBOXAMIDE

Default Structure
ChEBI IDCHEBI:42705
ChEBI Name1-((1R)-1-(HYDROXYMETHYL)-3-{6-[(5-PHENYLPENTANOYL)AMINO]-1H-INDOL-1-YL}PROPYL)-1H-IMIDAZOLE-4-CARBOXAMIDE
Stars
Last Modified17 October 2009
DownloadsMolfile
FormulaC27H31N5O3
Net Charge0
Average Mass473.577
Monoisotopic Mass473.24269
SMILES[H]OC([H])([H])[C@]([H])(n1c([H])nc(C(=O)N([H])[H])c1[H])C([H])([H])C([H])([H])n1c([H])c([H])c2c([H])c([H])c(N([H])C(=O)C([H])([H])C([H])([H])C([H])([H])C([H])([H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c21
InChIInChI=1S/C27H31N5O3/c28-27(35)24-17-32(19-29-24)23(18-33)13-15-31-14-12-21-10-11-22(16-25(21)31)30-26(34)9-5-4-8-20-6-2-1-3-7-20/h1-3,6-7,10-12,14,16-17,19,23,33H,4-5,8-9,13,15,18H2,(H2,28,35)(H,30,34)/t23-/m1/s1
InChIKeySLLHIZOLSGWMLR-HSZRJFAPSA-N
ChEBI Ontology
Outgoing Relation(s)
1-((1R)-1-(HYDROXYMETHYL)-3-{6-[(5-PHENYLPENTANOYL)AMINO]-1H-INDOL-1-YL}PROPYL)-1H-IMIDAZOLE-4-CARBOXAMIDE (CHEBI:42705) is a unclassifieds (CHEBI:27189)
Synonyms  Source
1-[(1R)-1-(hydroxymethyl)-3-{6-[(5-phenylpentanoyl)amino]-1H-indol-1-yl}propyl]-1H-imidazole-4-carboxamidePDBeChem
1-((1R)-1-(HYDROXYMETHYL)-3-{6-[(5-PHENYLPENTANOYL)AMINO]-1H-INDOL-1-YL}PROPYL)-1H-IMIDAZOLE-4-CARBOXAMIDEPDBeChem
Manual XrefsDatabases
FR8PDBeChem