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CHEBI:31839 - Meticrane

ChEBI IDCHEBI:31839
ChEBI NameMeticrane
Stars
Secondary ChEBI IDCHEBI:94670
Last Modified6 March 2017
DownloadsMolfile
FormulaC10H13NO4S2
Net Charge0
Average Mass275.351
Monoisotopic Mass275.02860
SMILESCc1cc2c(cc1S(N)(=O)=O)S(=O)(=O)CCC2
InChIInChI=1S/C10H13NO4S2/c1-7-5-8-3-2-4-16(12,13)10(8)6-9(7)17(11,14)15/h5-6H,2-4H2,1H3,(H2,11,14,15)
InChIKeyFNQQBFNIYODEMB-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
Meticrane (CHEBI:31839) is a thiochromane (CHEBI:50747)
Synonyms  Source
MeticraneKEGG COMPOUND
meticranDrugCentral
arrestenDrugCentral
Manual XrefsDatabases
D01605KEGG DRUG
LSM-5683LINCS
1777DrugCentral
Registry NumbersSources
CAS:1084-65-7KEGG COMPOUND
CAS:1084-65-7DrugCentral