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CHEBI:197915 - Decaspirone G

Default Structure
ChEBI IDCHEBI:197915
ChEBI NameDecaspirone G
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC20H16O5
Net Charge0
Average Mass336.343
Monoisotopic Mass336.09977
SMILESO=C1C=C[C@@H](O)[C@@H]2[C@@H]1[C@@H](O)C=CC21Oc2cccc3cccc(c23)O1
InChIInChI=1S/C20H16O5/c21-12-7-8-14(23)19-18(12)13(22)9-10-20(19)24-15-5-1-3-11-4-2-6-16(25-20)17(11)15/h1-10,13-14,18-19,22-23H/t13-,14+,18-,19+/m0/s1
InChIKeyWKESGSKGMIPHTP-QABNGEJJSA-N
Species of MetaboliteComponentSourceComments
Drepanospora viridis (ncbitaxon:339346) - PubMed (17190440)
ChEBI Ontology
Outgoing Relation(s)
Decaspirone G (CHEBI:197915) is a naphthalenes (CHEBI:25477)
IUPAC Name 
(4'R,4'aS,8'S,8'aR)-4',8'-dihydroxyspiro[2,4-dioxatricyclo[7.3.1.05,13]trideca-1(12),5,7,9(13),10-pentaene-3,5'-4,4a,8,8a-tetrahydronaphthalene]-1'-one
Manual XrefsDatabases
78436296ChemSpider