CHEBI:212587 - Thielavin Z5

ChEBI IDCHEBI:212587
ChEBI NameThielavin Z5
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SubmitterMetaboLights
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FormulaC28H28O10
Net Charge0
Average Mass524.522
Monoisotopic Mass524.16825
SMILESCOc1c(C)c(OC(=O)c2c(C)cc(O)cc2O)cc(C)c1C(=O)Oc1c(C)c(C)c(C(=O)O)c(O)c1C
InChIInChI=1S/C28H28O10/c1-11-8-17(29)10-18(30)20(11)27(34)37-19-9-12(2)21(25(36-7)15(19)5)28(35)38-24-14(4)13(3)22(26(32)33)23(31)16(24)6/h8-10,29-31H,1-7H3,(H,32,33)
InChIKeyRSJWOBATSKEXTC-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Thielavia (ncbitaxon:35719) - PubMed (28468259)
ChEBI Ontology
Outgoing Relation(s)
Thielavin Z5 (CHEBI:212587) is a carbonyl compound (CHEBI:36586)
IUPAC Name 
4-[4-(2,4-dihydroxy-6-methylbenzoyl)oxy-2-methoxy-3,6-dimethylbenzoyl]oxy-2-hydroxy-3,5,6-trimethylbenzoic acid
Manual XrefsDatabases
61708669ChemSpider