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CHEBI:200691 - Scytalol B

ChEBI IDCHEBI:200691
ChEBI NameScytalol B
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SubmitterMetaboLights
DownloadsMolfile
FormulaC16H20O6
Net Charge0
Average Mass308.330
Monoisotopic Mass308.12599
SMILESCOc1cc(O)c2c(c1)[C@H](O)C1C[C@@](C)(OC)OCC1C2=O
InChIInChI=1S/C16H20O6/c1-16(21-3)6-10-11(7-22-16)15(19)13-9(14(10)18)4-8(20-2)5-12(13)17/h4-5,10-11,14,17-18H,6-7H2,1-3H3/t10?,11?,14-,16-/m0/s1
InChIKeyVMMAWQXIQXLFRX-GVSXRFJSSA-N
Species of MetaboliteComponentSourceComments
Scytalidium (ncbitaxon:5538) - PubMed (9630860)
ChEBI Ontology
Outgoing Relation(s)
Scytalol B (CHEBI:200691) is a organic heterotricyclic compound (CHEBI:26979)
Scytalol B (CHEBI:200691) is a organooxygen compound (CHEBI:36963)
IUPAC Name 
(3S,5R)-5,9-dihydroxy-3,7-dimethoxy-3-methyl-4,4a,5,10a-tetrahydro-1H-benzo[g]isochromen-10-one
Manual XrefsDatabases
78436649ChemSpider