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CHEBI:203457 - Atranone H

ChEBI IDCHEBI:203457
ChEBI NameAtranone H
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC24H32O8
Net Charge0
Average Mass448.512
Monoisotopic Mass448.20972
SMILESC/C1=C/C[C@H]2[C@](C)(CC/C(C)=C3/OC(=O)[C@H]4[C@@H]3[C@@H]1O[C@@]4(C)O)OC(=O)C(=O)[C@]2(O)C(C)C
InChIInChI=1S/C24H32O8/c1-11(2)24(29)14-8-7-12(3)18-15-16(23(6,28)31-18)20(26)30-17(15)13(4)9-10-22(14,5)32-21(27)19(24)25/h7,11,14-16,18,28-29H,8-10H2,1-6H3/b12-7-,17-13+/t14-,15-,16+,18+,22-,23+,24-/m0/s1
InChIKeyACYYQFZAPACISZ-BATKGCHASA-N
Species of MetaboliteComponentSourceComments
Stachybotrys chartarum (ncbitaxon:74722) - DOI (10.1002/mrc.1186)
ChEBI Ontology
Outgoing Relation(s)
Atranone H (CHEBI:203457) is a furofuran (CHEBI:47790)
IUPAC Name 
(1E,5S,9S,10R,12Z,14S,16R,17S,20R)-9,16-dihydroxy-2,5,13,16-tetramethyl-9-propan-2-yl-6,15,19-trioxatetracyclo[12.5.1.05,10.017,20]icosa-1,12-diene-7,8,18-trione