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CHEBI:212303 - Microsphaeropsisin B

ChEBI IDCHEBI:212303
ChEBI NameMicrosphaeropsisin B
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SubmitterMetaboLights
DownloadsMolfile
FormulaC15H20O4
Net Charge0
Average Mass264.321
Monoisotopic Mass264.13616
SMILESC[C@@H]1C(=O)C=CC2=C[C@]3(O)OC[C@H](C)[C@]3(O)C[C@@]21C
InChIInChI=1S/C15H20O4/c1-9-7-19-15(18)6-11-4-5-12(16)10(2)13(11,3)8-14(9,15)17/h4-6,9-10,17-18H,7-8H2,1-3H3/t9-,10+,13+,14+,15-/m0/s1
InChIKeyMYRFLPCACLVXHC-HLXQIYJLSA-N
ChEBI Ontology
Outgoing Relation(s)
Microsphaeropsisin B (CHEBI:212303) is a naphthofuran (CHEBI:39270)
IUPAC Name 
(3S,3aR,4aR,5S,9aS)-3a,9a-dihydroxy-3,4a,5-trimethyl-2,3,4,5-tetrahydrobenzo[][1]benzouran-6-one
Manual XrefsDatabases
61362078ChemSpider