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CHEBI:206945 - 18-oxo-19-hydroxyl-19,20-dihydrophomacin C

ChEBI IDCHEBI:206945
ChEBI Name18-oxo-19-hydroxyl-19,20-dihydrophomacin C
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC26H39NO5
Net Charge0
Average Mass445.600
Monoisotopic Mass445.28282
SMILESCO[C@@H]1CC(=O)[C@@]23C(=O)N[C@@H](CC(C)C)[C@@H]2[C@H](C)C(C)=C[C@@H]3/C=C(\C)C[C@H](CO)CC1=O
InChIInChI=1S/C26H39NO5/c1-14(2)7-20-24-17(5)16(4)10-19-9-15(3)8-18(13-28)11-21(29)22(32-6)12-23(30)26(19,24)25(31)27-20/h9-10,14,17-20,22,24,28H,7-8,11-13H2,1-6H3,(H,27,31)/b15-9+/t17-,18+,19+,20+,22-,24+,26-/m1/s1
InChIKeyOAOOMDJOUWPNCG-NUVFGYADSA-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)
18-oxo-19-hydroxyl-19,20-dihydrophomacin C (CHEBI:206945) has role fungal metabolite (CHEBI:76946)
18-oxo-19-hydroxyl-19,20-dihydrophomacin C (CHEBI:206945) is a cytochalasin (CHEBI:23528)
IUPAC Name 
(1S,4R,7S,9E,11S,14S,15R,16S)-7-(hydroxymethyl)-4-methoxy-9,13,14-trimethyl-16-(2-methylpropyl)-17-azatricyclo[9.7.0.01,15]octadeca-9,12-diene-2,5,18-trione
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63002591ChemSpider