CHEBI:212529 - Thielavin Z6

ChEBI IDCHEBI:212529
ChEBI NameThielavin Z6
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC30H31ClO10
Net Charge0
Average Mass587.021
Monoisotopic Mass586.16057
SMILESCOc1c(C)c(OC(=O)c2c(C)c(Cl)c(O)c(C)c2O)c(C)c(C)c1C(=O)Oc1c(C)c(C)c(C(=O)O)c(O)c1C
InChIInChI=1S/C30H31ClO10/c1-10-12(3)25(16(7)23(33)18(10)28(35)36)40-30(38)20-11(2)13(4)26(17(8)27(20)39-9)41-29(37)19-14(5)21(31)24(34)15(6)22(19)32/h32-34H,1-9H3,(H,35,36)
InChIKeyMJZHMSVXOFMDTF-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Thielavia (ncbitaxon:35719) - PubMed (28468259)
ChEBI Ontology
Outgoing Relation(s)
Thielavin Z6 (CHEBI:212529) is a carbonyl compound (CHEBI:36586)
IUPAC Name 
4-[4-(5-chloro-2,4-dihydroxy-3,6-dimethylbenzoyl)oxy-2-methoxy-3,5,6-trimethylbenzoyl]oxy-2-hydroxy-3,5,6-trimethylbenzoic acid
Manual XrefsDatabases
61708670ChemSpider