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CHEBI:31238 - Arnottin II

ChEBI IDCHEBI:31238
ChEBI NameArnottin II
Stars
Last Modified28 July 2014
DownloadsMolfile
FormulaC20H14O7
Net Charge0
Average Mass366.325
Monoisotopic Mass366.07395
SMILESCOc1ccc2c(c1OC)C(=O)O[C@]21C=Cc2cc3c(cc2C1=O)OCO3
InChIInChI=1S/C20H14O7/c1-23-13-4-3-12-16(17(13)24-2)19(22)27-20(12)6-5-10-7-14-15(26-9-25-14)8-11(10)18(20)21/h3-8H,9H2,1-2H3/t20-/m1/s1
InChIKeyJEHSMJTYFMMHKE-HXUWFJFHSA-N
ChEBI Ontology
Outgoing Relation(s)
Arnottin II (CHEBI:31238) is a 2-benzofurans (CHEBI:38831)
Synonym  Source
Arnottin IIKEGG COMPOUND
Manual XrefsDatabases
C12258KEGG COMPOUND