CHEBI:204588 - Thielavin M

ChEBI IDCHEBI:204588
ChEBI NameThielavin M
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SubmitterMetaboLights
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FormulaC29H30O10
Net Charge0
Average Mass538.549
Monoisotopic Mass538.18390
SMILESCOc1c(C)c(OC(=O)c2c(C)cc(O)cc2O)c(C)c(C)c1C(=O)Oc1c(C)c(C)c(C(=O)O)c(O)c1C
InChIInChI=1S/C29H30O10/c1-11-9-18(30)10-19(31)20(11)28(35)39-25-15(5)13(3)22(26(37-8)17(25)7)29(36)38-24-14(4)12(2)21(27(33)34)23(32)16(24)6/h9-10,30-32H,1-8H3,(H,33,34)
InChIKeyCAWJTNCJDAQEAS-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Chaetomium (ncbitaxon:5149) - PubMed (12546415)
ChEBI Ontology
Outgoing Relation(s)
Thielavin M (CHEBI:204588) is a carbonyl compound (CHEBI:36586)
IUPAC Name 
4-[4-(2,4-dihydroxy-6-methylbenzoyl)oxy-2-methoxy-3,5,6-trimethylbenzoyl]oxy-2-hydroxy-3,5,6-trimethylbenzoic acid
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