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CHEBI:222820 - Norperistictic acid

ChEBI IDCHEBI:222820
ChEBI NameNorperistictic acid
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC18H12O10
Net Charge0
Average Mass388.284
Monoisotopic Mass388.04305
SMILESCc1cc(O)c(C(=O)O)c2c1C(=O)Oc1c(C)c(O)c3c(c1O2)[C@@H](O)OC3=O
InChIInChI=1S/C18H12O10/c1-4-3-6(19)8(15(21)22)13-7(4)16(23)27-12-5(2)11(20)9-10(14(12)26-13)18(25)28-17(9)24/h3,18-20,25H,1-2H3,(H,21,22)/t18-/m0/s1
InChIKeyYGHQAMXBZNTFBI-SFHVURJKSA-N
Species of MetaboliteComponentSourceComments
Phaeographis (ncbitaxon:297881) - DOI (10.1071/ch02194)
Roles Classification
Application:
endocrine disruptor  Any compound that can disrupt the functions of the endocrine (hormone) system
ChEBI Ontology
Outgoing Relation(s)
Norperistictic acid (CHEBI:222820) is a phthalate ester (CHEBI:35484)
IUPAC Name 
5,13,17-trihydroxy-7,12-dimethyl-9,15-dioxo-2,10,16-trioxatetracyclo[9.7.0.03,8.014,18]octadeca-1(11),3(8),4,6,12,14(18)-hexaene-4-carboxylic acid
Manual XrefsDatabases
78435482ChemSpider