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CHEBI:202263 - Terreumol A

ChEBI IDCHEBI:202263
ChEBI NameTerreumol A
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC17H20O6
Net Charge0
Average Mass320.341
Monoisotopic Mass320.12599
SMILESCOc1cc(O)c2c(c1O)C[C@]1(C)O[C@@H]1CC[C@@]1(C)O[C@@H]1C2=O
InChIInChI=1S/C17H20O6/c1-16-5-4-11-17(2,22-11)7-8-12(14(20)15(16)23-16)9(18)6-10(21-3)13(8)19/h6,11,15,18-19H,4-5,7H2,1-3H3/t11-,15-,16-,17+/m1/s1
InChIKeyKLHZTHGOEWAZJD-AHBIMHKDSA-N
Species of MetaboliteComponentSourceComments
Tricholoma terreum (ncbitaxon:76328) - PubMed (23837944)
ChEBI Ontology
Outgoing Relation(s)
Terreumol A (CHEBI:202263) is a methoxybenzenes (CHEBI:51683)
IUPAC Name 
(3S,5R,8R,10S)-13,16-dihydroxy-14-methoxy-5,10-dimethyl-4,9-dioxatetracyclo[10.4.0.03,5.08,10]hexadeca-1(12),13,15-trien-2-one
Manual XrefsDatabases
30824253ChemSpider