CHEBI:9035 - Sarothralin

ChEBI IDCHEBI:9035
ChEBI NameSarothralin
Stars
Last Modified28 July 2014
DownloadsMolfile
FormulaC31H34O8
Net Charge0
Average Mass534.605
Monoisotopic Mass534.22537
SMILESCC(C)=CCOc1cc(O)c(CC2=C(O)C(C)(C)C(O)=C(C(=O)C(C)C)C2=O)c(O)c1C(=O)c1ccccc1
InChIInChI=1S/C31H34O8/c1-16(2)12-13-39-22-15-21(32)19(27(35)23(22)26(34)18-10-8-7-9-11-18)14-20-28(36)24(25(33)17(3)4)30(38)31(5,6)29(20)37/h7-12,15,17,32,35,37-38H,13-14H2,1-6H3
InChIKeyFWISFRPDKDPZRN-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
Sarothralin (CHEBI:9035) is a benzophenones (CHEBI:22726)
Synonym  Source
SarothralinKEGG COMPOUND
Manual XrefsDatabases
C09969KEGG COMPOUND
C00003017KNApSAcK
Registry NumbersSources
CAS:96624-40-7KEGG COMPOUND