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CHEBI:189294 - Gelomulide N

ChEBI IDCHEBI:189294
ChEBI NameGelomulide N
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC24H32O7
Net Charge0
Average Mass432.513
Monoisotopic Mass432.21480
SMILES[H][C@@]12C[C@@]3([H])OC(=O)C(C)=C3[C@@]3([H])O[C@@]13CC[C@]1([H])C(C)(C)[C@@H](OC(C)=O)C[C@H](OC(C)=O)[C@@]21C
InChIInChI=1S/C24H32O7/c1-11-19-14(30-21(11)27)9-16-23(6)15(7-8-24(16)20(19)31-24)22(4,5)17(28-12(2)25)10-18(23)29-13(3)26/h14-18,20H,7-10H2,1-6H3/t14-,15-,16+,17+,18+,20-,23-,24+/m1/s1
InChIKeyYOELDOOOBJSHSZ-SRFZOMHBSA-N
Species of MetaboliteComponentSourceComments
Arabidopsis thaliana (ncbitaxon:3702) leaf (BTO:0000713) MetaboLights (MTBLS3997)
ChEBI Ontology
Outgoing Relation(s)
Gelomulide N (CHEBI:189294) is a naphthofuran (CHEBI:39270)
IUPAC Name 
[(1S,3R,8R,10S,11R,12S,14S,16R)-12-acetyloxy-5,11,15,15-tetramethyl-6-oxo-2,7-dioxapentacyclo[8.8.0.01,3.04,8.011,16]octadec-4-en-14-yl] acetate
Manual XrefsDatabases
22913473ChemSpider