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CHEBI:212211 - Roseobacticide K

ChEBI IDCHEBI:212211
ChEBI NameRoseobacticide K
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SubmitterMetaboLights
DownloadsMolfile
FormulaC30H18O5S2
Net Charge0
Average Mass522.603
Monoisotopic Mass522.05957
SMILESO=c1oc2cc(SSc3cccc4c(-c5ccc(O)cc5)c(=O)oc-4c3)cccc-2c1-c1ccccc1
InChIInChI=1S/C30H18O5S2/c31-20-14-12-19(13-15-20)28-24-11-5-9-22(17-26(24)35-30(28)33)37-36-21-8-4-10-23-25(16-21)34-29(32)27(23)18-6-2-1-3-7-18/h1-17,31H
InChIKeyMLXVGOSFOASRIA-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Phaeobacter gallaeciensis (ncbitaxon:60890) - PubMed (21928816)
ChEBI Ontology
Outgoing Relation(s)
Roseobacticide K (CHEBI:212211) is a cycloheptafuran (CHEBI:39435)
IUPAC Name 
7-[[3-(4-hydroxyphenyl)-2-oxocyclohepta[b]uran-7-yl]disulanyl]-3-phenylcyclohepta[b]uran-2-one
Manual XrefsDatabases
28289437ChemSpider