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CHEBI:4937 - Eupatoriopicrin

ChEBI IDCHEBI:4937
ChEBI NameEupatoriopicrin
Stars
Last Modified28 July 2014
DownloadsMolfile
FormulaC20H26O6
Net Charge0
Average Mass362.422
Monoisotopic Mass362.17294
SMILES[H][C@@]12/C=C(\C)CC/C=C(\C)C[C@@H](OC(=O)/C(=C/CO)CO)[C@@]1([H])C(=C)C(=O)O2
InChIInChI=1S/C20H26O6/c1-12-5-4-6-13(2)10-17(26-20(24)15(11-22)7-8-21)18-14(3)19(23)25-16(18)9-12/h6-7,9,16-18,21-22H,3-5,8,10-11H2,1-2H3/b12-9+,13-6+,15-7+/t16-,17-,18+/m1/s1
InChIKeyVWJYWGYJIDQUEG-DKDOXNMLSA-N
ChEBI Ontology
Outgoing Relation(s)
Eupatoriopicrin (CHEBI:4937) is a germacranolide (CHEBI:73011)
Synonym  Source
EupatoriopicrinKEGG COMPOUND
Manual XrefsDatabases
C09442KEGG COMPOUND
C00003278KNApSAcK
Registry NumbersSources
CAS:6856-01-5KEGG COMPOUND