CHEBI:204359 - Epoxyvirone

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name Epoxyvirone
ChEBI ID CHEBI:204359
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C22H24O5
Net Charge 0
Average Mass 368.429
Monoisotopic Mass 368.16237
InChI InChI=1S/C22H24O5/c1-9(23)11-4-5-12-14-13(6-7-21(11,12)2)22(3)15-10(8-26-18(15)17(14)25)16(24)19-20(22)27-19/h8,11-12,16,19-20,24H,4-7H2,1-3H3/t11-,12+,16-,19+,20+,21-,22-/m1/s1
InChIKey JQHSHPAZNWYGEU-FGWJHSTMSA-N
SMILES O=C1C2=C([C@]3([C@H]4O[C@H]4[C@@H](C=5C3=C1OC5)O)C)CC[C@]6([C@H]2CC[C@@H]6C(=O)C)C
Metabolite of Species Details
Talaromyces (NCBI:txid5094) See: DOI
ChEBI Ontology
Outgoing Epoxyvirone (CHEBI:204359) is a naphthofuran (CHEBI:39270)
IUPAC Name
(1R,5S,6S,9R,16R,17S,19R)-6-acetyl-16-hydroxy-1,5-dimethyl-13,18-dioxahexacyclo[10.7.1.02,10.05,9.015,20.017,19]icosa-2(10),12(20),14-trien-11-one
Manual Xref Database
78437128 ChemSpider
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