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CHEBI:144229 - Sphaerophorin

Default Structure
ChEBI IDCHEBI:144229
ChEBI NameSphaerophorin
Stars
Submittermwilliams
DownloadsMolfile
FormulaC23H28O7
Net Charge0
Average Mass416.470
Monoisotopic Mass416.18350
SMILESCCCCCCCc1cc(OC(=O)c2c(C)cc(OC)cc2O)cc(O)c1C(=O)O
InChIInChI=1S/C23H28O7/c1-4-5-6-7-8-9-15-11-17(13-19(25)21(15)22(26)27)30-23(28)20-14(2)10-16(29-3)12-18(20)24/h10-13,24-25H,4-9H2,1-3H3,(H,26,27)
InChIKeyLNAYIVMXSQCRRC-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
Sphaerophorin (CHEBI:144229) is a carbonyl compound (CHEBI:36586)