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CHEBI:31438 - Cromoglicate lisetil

ChEBI IDCHEBI:31438
ChEBI NameCromoglicate lisetil
Stars
Last Modified6 March 2017
DownloadsMolfile
FormulaC33H36N2O12
Net Charge0
Average Mass652.653
Monoisotopic Mass652.22682
SMILESCCOC(=O)c1cc(=O)c2c(OCC(COc3cccc4oc(C(=O)OCC)cc(=O)c34)OC(=O)[C@@H](N)CCCCN)cccc2o1
InChIInChI=1S/C33H36N2O12/c1-3-41-32(39)27-15-21(36)29-23(10-7-12-25(29)46-27)43-17-19(45-31(38)20(35)9-5-6-14-34)18-44-24-11-8-13-26-30(24)22(37)16-28(47-26)33(40)42-4-2/h7-8,10-13,15-16,19-20H,3-6,9,14,17-18,34-35H2,1-2H3/t20-/m0/s1
InChIKeyNGJJDHCBOKNREV-FQEVSTJZSA-N
ChEBI Ontology
Outgoing Relation(s)
Cromoglicate lisetil (CHEBI:31438) is a α-amino acid ester (CHEBI:46874)
Synonym  Source
Cromoglicate lisetilKEGG COMPOUND
Manual XrefsDatabases
D02589KEGG DRUG
Registry NumbersSources
CAS:110816-79-0KEGG COMPOUND