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CHEBI:206963 - 19-hydroxyl-19,20-dihydrophomacin C

ChEBI IDCHEBI:206963
ChEBI Name19-hydroxyl-19,20-dihydrophomacin C
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC25H39NO5
Net Charge0
Average Mass433.589
Monoisotopic Mass433.28282
SMILESCC1=C[C@@H]2/C=C(\C)C[C@H](CO)C[C@H](O)[C@@H](O)CC(=O)[C@]23C(=O)N[C@@H](CC(C)C)[C@@H]3[C@@H]1C
InChIInChI=1S/C25H39NO5/c1-13(2)6-19-23-16(5)15(4)9-18-8-14(3)7-17(12-27)10-20(28)21(29)11-22(30)25(18,23)24(31)26-19/h8-9,13,16-21,23,27-29H,6-7,10-12H2,1-5H3,(H,26,31)/b14-8+/t16-,17+,18+,19+,20+,21+,23+,25-/m1/s1
InChIKeyJEPMATUFQDEVNO-AYHVEROOSA-N
Species of MetaboliteComponentSourceComments
Westerdykella dispersa (ncbitaxon:45154) - PubMed (28931947)
Roles Classification
Biological Role:
fungal metabolite  Any eukaryotic metabolite produced during a metabolic reaction in fungi, the kingdom that includes microorganisms such as the yeasts and moulds.
ChEBI Ontology
Outgoing Relation(s)
19-hydroxyl-19,20-dihydrophomacin C (CHEBI:206963) has role fungal metabolite (CHEBI:76946)
19-hydroxyl-19,20-dihydrophomacin C (CHEBI:206963) is a cytochalasin (CHEBI:23528)
IUPAC Name 
(1S,4S,5S,7S,9E,11S,14S,15R,16S)-4,5-dihydroxy-7-(hydroxymethyl)-9,13,14-trimethyl-16-(2-methylpropyl)-17-azatricyclo[9.7.0.01,15]octadeca-9,12-diene-2,18-dione
Manual XrefsDatabases
63002594ChemSpider