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CHEBI:175483 - Oryzalic acid A

ChEBI IDCHEBI:175483
ChEBI NameOryzalic acid A
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SubmitterMetaboLights
DownloadsMolfile
FormulaC20H30O5
Net Charge0
Average Mass350.455
Monoisotopic Mass350.20932
SMILESCC(C)(C(=O)O)C1CCC23CC(CCC2C1(C)CC(=O)O)C1(C)OC31
InChIInChI=1S/C20H30O5/c1-17(2,16(23)24)12-7-8-20-9-11(19(4)15(20)25-19)5-6-13(20)18(12,3)10-14(21)22/h11-13,15H,5-10H2,1-4H3,(H,21,22)(H,23,24)
InChIKeyQGTMYAPGXJWNQR-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
Oryzalic acid A (CHEBI:175483) is a oxanes (CHEBI:46942)
IUPAC Name 
2-[5-(carboxymethyl)-5,10-dimethyl-11-oxatetracyclo[7.3.1.01,6.010,12]tridecan-4-yl]-2-methylpropanoic acid
Manual XrefsDatabases
HMDB0037593HMDB
35014441ChemSpider