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CHEBI:206471 - Montagnuphilone C

ChEBI IDCHEBI:206471
ChEBI NameMontagnuphilone C
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SubmitterMetaboLights
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FormulaC21H24O10
Net Charge0
Average Mass436.413
Monoisotopic Mass436.13695
SMILESCc1cc(O)cc(O)c1C(=O)O[C@H]1CC2=C(CO[C@@](O)(CCC(=O)O)C2)C(=O)[C@@]1(C)O
InChIInChI=1S/C21H24O10/c1-10-5-12(22)7-14(23)17(10)19(27)31-15-6-11-8-21(29,4-3-16(24)25)30-9-13(11)18(26)20(15,2)28/h5,7,15,22-23,28-29H,3-4,6,8-9H2,1-2H3,(H,24,25)/t15-,20-,21-/m0/s1
InChIKeyUGUYPVZDRVCYAD-JHVJFLLYSA-N
Roles Classification
Biological Role:
fungal metabolite  Any eukaryotic metabolite produced during a metabolic reaction in fungi, the kingdom that includes microorganisms such as the yeasts and moulds.
ChEBI Ontology
Outgoing Relation(s)
Montagnuphilone C (CHEBI:206471) is a azaphilone (CHEBI:50941)
IUPAC Name 
3-[(3S,6S,7S)-6-(2,4-dihydroxy-6-methylbenzoyl)oxy-3,7-dihydroxy-7-methyl-8-oxo-1,4,5,6-tetrahydroisochromen-3-yl]propanoic acid
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