CHEBI:192273 - Colletotric acid

ChEBI IDCHEBI:192273
ChEBI NameColletotric acid
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC28H28O10
Net Charge0
Average Mass524.522
Monoisotopic Mass524.16825
SMILESCOc1c(C)c(OC(=O)c2c(C)cc(O)cc2O)c(C)c(C(=O)Oc2cc(O)c(C(=O)O)c(C)c2C)c1C
InChIInChI=1S/C28H28O10/c1-11-8-17(29)9-18(30)21(11)27(34)38-25-15(5)22(14(4)24(36-7)16(25)6)28(35)37-20-10-19(31)23(26(32)33)13(3)12(20)2/h8-10,29-31H,1-7H3,(H,32,33)
InChIKeyXCQZDTOTILKBSN-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Colletotrichum sublineola (ncbitaxon:1173701) - MetaboLights (MTBLS735)
ChEBI Ontology
Outgoing Relation(s)
Colletotric acid (CHEBI:192273) is a carbonyl compound (CHEBI:36586)
IUPAC Name 
4-[3-(2,4-dihydroxy-6-methylbenzoyl)oxy-5-methoxy-2,4,6-trimethylbenzoyl]oxy-6-hydroxy-2,3-dimethylbenzoic acid
Manual XrefsDatabases
8159880ChemSpider