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CHEBI:220531 - IBR-2

ChEBI IDCHEBI:220531
ChEBI NameIBR-2
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC19H24O8
Net Charge0
Average Mass380.393
Monoisotopic Mass380.14712
SMILESCOc1cc(OC)c2c(OC3O[C@@H](C)[C@H](O)[C@@H](O)[C@H]3O)cc(OC)cc2c1
InChIInChI=1S/C19H24O8/c1-9-16(20)17(21)18(22)19(26-9)27-14-8-12(24-3)6-10-5-11(23-2)7-13(25-4)15(10)14/h5-9,16-22H,1-4H3/t9-,16-,17+,18+,19?/m0/s1
InChIKeyCRGQDANSZYGKQI-BPEZXKGVSA-N
Species of MetaboliteComponentSourceComments
Nocardia (ncbitaxon:1817) - PubMed (30634706)
ChEBI Ontology
Outgoing Relation(s)
IBR-2 (CHEBI:220531) is a naphthalenes (CHEBI:25477)