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CHEBI:213506 - Parmetherine C

ChEBI IDCHEBI:213506
ChEBI NameParmetherine C
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SubmitterMetaboLights
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FormulaC30H28O14
Net Charge0
Average Mass612.540
Monoisotopic Mass612.14791
SMILESCOC(=O)c1c(C)c(Cc2c(O)c(Oc3c(C=O)c(O)cc(C)c3C(=O)OC)c3c(c2O)C(=O)O[C@@H]3OC)c(O)c(C)c1O
InChIInChI=1S/C30H28O14/c1-10-7-16(32)15(9-31)25(17(10)27(37)40-4)43-26-20-19(29(39)44-30(20)42-6)23(35)14(24(26)36)8-13-11(2)18(28(38)41-5)22(34)12(3)21(13)33/h7,9,30,32-36H,8H2,1-6H3/t30-/m0/s1
InChIKeyBPCWXBUBUVMYDM-PMERELPUSA-N
Species of MetaboliteComponentSourceComments
Parmotrema dilatatum (ncbitaxon:2559076) - PubMed (32819010)
ChEBI Ontology
Outgoing Relation(s)
Parmetherine C (CHEBI:213506) is a aromatic ether (CHEBI:35618)
IUPAC Name 
methyl 5-[[7-(2-ormyl-3-hydroxy-6-methoxycarbonyl-5-methylphenoxy)-4,6-dihydroxy-1-methoxy-3-oxo-1H-2-benzouran-5-yl]methyl]-2,4-dihydroxy-3,6-dimethylbenzoate