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CHEBI:203852 - Hebetaeltin C

ChEBI IDCHEBI:203852
ChEBI NameHebetaeltin C
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC25H30O6
Net Charge0
Average Mass426.509
Monoisotopic Mass426.20424
SMILESC/C=C/C=C/c1cc(=O)c2c(o1)O[C@]1(C)CC[C@@]3(O)C(C)(C)C(=O)CC[C@@]34CO[C@@H]2[C@H]41
InChIInChI=1S/C25H30O6/c1-5-6-7-8-15-13-16(26)18-19-20-23(4,31-21(18)30-15)11-12-25(28)22(2,3)17(27)9-10-24(20,25)14-29-19/h5-8,13,19-20,28H,9-12,14H2,1-4H3/b6-5+,8-7+/t19-,20-,23+,24-,25+/m0/s1
InChIKeyLEVFOQZSXJAMIP-IHPDWLGDSA-N
Species of MetaboliteComponentSourceComments
Penicillium (ncbitaxon:5073) - DOI (10.1016/j.tetlet.2010.11.140)
ChEBI Ontology
Outgoing Relation(s)
Hebetaeltin C (CHEBI:203852) is a organic heterotricyclic compound (CHEBI:26979)
Hebetaeltin C (CHEBI:203852) is a organooxygen compound (CHEBI:36963)
IUPAC Name 
(1R,4R,12R,15S,20S)-15-hydroxy-12,16,16-trimethyl-8-[(1E,3E)-penta-1,3-dienyl]-3,9,11-trioxapentacyclo[10.7.1.01,15.04,20.05,10]icosa-5(10),7-diene-6,17-dione