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CHEBI:223197 - Wortmannin D

ChEBI IDCHEBI:223197
ChEBI NameWortmannin D
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC25H28O8
Net Charge0
Average Mass456.491
Monoisotopic Mass456.17842
SMILESCOC[C@H]1OC(=O)c2coc3c2[C@@]1(C)C1=C(C3=O)[C@@H]2CCC(=O)[C@@]2(C)C[C@H]1OC(=O)C(C)C
InChIInChI=1S/C25H28O8/c1-11(2)22(28)32-14-8-24(3)13(6-7-15(24)26)17-19(14)25(4)16(10-30-5)33-23(29)12-9-31-21(18(12)25)20(17)27/h9,11,13-14,16H,6-8,10H2,1-5H3/t13-,14+,16+,24-,25-/m0/s1
InChIKeyANVUBSHPPSOIFF-UMLLEVENSA-N
Species of MetaboliteComponentSourceComments
Niesslia (ncbitaxon:267679) - PubMed (30844268)
ChEBI Ontology
Outgoing Relation(s)
Wortmannin D (CHEBI:223197) is a oxa-steroid (CHEBI:50917)
IUPAC Name 
[(1R,3R,5S,9R,18S)-18-(methoxymethyl)-1,5-dimethyl-6,11,16-trioxo-13,17-dioxapentacyclo[10.6.1.02,10.05,9.015,19]nonadeca-2(10),12(19),14-trien-3-yl] 2-methylpropanoate