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CHEBI:201290 - Bybetaochlamic acid

ChEBI IDCHEBI:201290
ChEBI NameBybetaochlamic acid
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC18H20O6
Net Charge0
Average Mass332.352
Monoisotopic Mass332.12599
SMILESCCC[C@@H]1CC2=C(C[C@H](CC)CC3=C1C(=O)OC3=O)C(=O)OC2=O
InChIInChI=1S/C18H20O6/c1-3-5-10-8-12-11(15(19)23-16(12)20)6-9(4-2)7-13-14(10)18(22)24-17(13)21/h9-10H,3-8H2,1-2H3/t9-,10+/m0/s1
InChIKeyNRDWUPPIGBHWAS-VHSXEESVSA-N
Species of MetaboliteComponentSourceComments
Paecilomyces fulvus (ncbitaxon:89137) - PubMed (13904221)
ChEBI Ontology
Outgoing Relation(s)
Bybetaochlamic acid (CHEBI:201290) has functional parent tetracarboxylic acid (CHEBI:35742)
Bybetaochlamic acid (CHEBI:201290) is a organooxygen compound (CHEBI:36963)
IUPAC Name 
(2R,10S)-10-ethyl-2-propyl-6,14-dioxatricyclo[10.3.0.04,8]pentadeca-1(12),4(8)-diene-5,7,13,15-tetrone
Manual XrefsDatabases
29213593ChemSpider