EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:122011 - 2-[5-[(2-methoxy-1-naphthalenyl)methylidene]-4-oxo-3-[2-oxo-2-(2-oxolanylmethylamino)ethyl]-2-thiazolidinylidene]acetic acid ethyl ester

ChEBI IDCHEBI:122011
ChEBI Name2-[5-[(2-methoxy-1-naphthalenyl)methylidene]-4-oxo-3-[2-oxo-2-(2-oxolanylmethylamino)ethyl]-2-thiazolidinylidene]acetic acid ethyl ester
Stars
DownloadsMolfile
FormulaC26H28N2O6S
Net Charge0
Average Mass496.585
Monoisotopic Mass496.16681
SMILESCCOC(=O)C=c1sc(=Cc2c(OC)ccc3ccccc23)c(=O)n1CC(=O)NCC1CCCO1
InChIInChI=1S/C26H28N2O6S/c1-3-33-25(30)14-24-28(16-23(29)27-15-18-8-6-12-34-18)26(31)22(35-24)13-20-19-9-5-4-7-17(19)10-11-21(20)32-2/h4-5,7,9-11,13-14,18H,3,6,8,12,15-16H2,1-2H3,(H,27,29)
InChIKeyLOZNKRXXJGRBGK-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
2-[5-[(2-methoxy-1-naphthalenyl)methylidene]-4-oxo-3-[2-oxo-2-(2-oxolanylmethylamino)ethyl]-2-thiazolidinylidene]acetic acid ethyl ester (CHEBI:122011) is a naphthalenes (CHEBI:25477)
Manual XrefsDatabases
LSM-33454LINCS