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CHEBI:220257 - Hydroxy neovasinin

ChEBI IDCHEBI:220257
ChEBI NameHydroxy neovasinin
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC17H24O6
Net Charge0
Average Mass324.373
Monoisotopic Mass324.15729
SMILESC/C(=C\[C@H](C)[C@H](C)O)[C@H]1OCc2c(oc(=O)c(C)c2O)[C@@]1(C)O
InChIInChI=1S/C17H24O6/c1-8(11(4)18)6-9(2)14-17(5,21)15-12(7-22-14)13(19)10(3)16(20)23-15/h6,8,11,14,18-19,21H,7H2,1-5H3/b9-6+/t8-,11-,14+,17-/m0/s1
InChIKeyYPVPXINVSPPRIQ-XRKQRGLRSA-N
Species of MetaboliteComponentSourceComments
Aspergillus (ncbitaxon:5052) - PubMed (27806646)
ChEBI Ontology
Outgoing Relation(s)
Hydroxy neovasinin (CHEBI:220257) is a pyranone (CHEBI:37963)
IUPAC Name 
(7R,8S)-4,8-dihydroxy-7-[(E,4S,5S)-5-hydroxy-4-methylhex-2-en-2-yl]-3,8-dimethyl-5,7-dihydropyrano[4,3-b]pyran-2-one
Manual XrefsDatabases
78439548ChemSpider