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CHEBI:6739 - Melosatin A

ChEBI IDCHEBI:6739
ChEBI NameMelosatin A
Stars
Last Modified28 July 2014
DownloadsMolfile
FormulaC21H23NO4
Net Charge0
Average Mass353.418
Monoisotopic Mass353.16271
SMILESCOc1cc(CCCCCc2ccccc2)c2c(c1OC)NC(=O)C2=O
InChIInChI=1S/C21H23NO4/c1-25-16-13-15(12-8-4-7-11-14-9-5-3-6-10-14)17-18(20(16)26-2)22-21(24)19(17)23/h3,5-6,9-10,13H,4,7-8,11-12H2,1-2H3,(H,22,23,24)
InChIKeyYRBBTNSJJXHMPP-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
Melosatin A (CHEBI:6739) is a indoles (CHEBI:24828)
Synonym  Source
Melosatin AKEGG COMPOUND
Manual XrefsDatabases
C09221KEGG COMPOUND
C00001746KNApSAcK
Registry NumbersSources
CAS:64838-04-6KEGG COMPOUND