CHEBI:212581 - Thielavin Z4

ChEBI IDCHEBI:212581
ChEBI NameThielavin Z4
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SubmitterMetaboLights
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FormulaC27H26O10
Net Charge0
Average Mass510.495
Monoisotopic Mass510.15260
SMILESCOc1c(C)c(OC(=O)c2c(C)cc(O)cc2O)cc(C)c1C(=O)Oc1cc(C)c(C(=O)O)c(O)c1C
InChIInChI=1S/C27H26O10/c1-11-7-16(28)10-17(29)20(11)26(33)37-19-9-13(3)22(24(35-6)15(19)5)27(34)36-18-8-12(2)21(25(31)32)23(30)14(18)4/h7-10,28-30H,1-6H3,(H,31,32)
InChIKeyGYMXYUCNOOOJKD-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Thielavia (ncbitaxon:35719) - PubMed (28468259)
ChEBI Ontology
Outgoing Relation(s)
Thielavin Z4 (CHEBI:212581) is a carbonyl compound (CHEBI:36586)
IUPAC Name 
4-[4-(2,4-dihydroxy-6-methylbenzoyl)oxy-2-methoxy-3,6-dimethylbenzoyl]oxy-2-hydroxy-3,6-dimethylbenzoic acid
Manual XrefsDatabases
61708668ChemSpider