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CHEBI:9981 - Viguiestenin

ChEBI IDCHEBI:9981
ChEBI NameViguiestenin
Stars
Last Modified28 July 2014
DownloadsMolfile
FormulaC21H28O7
Net Charge0
Average Mass392.448
Monoisotopic Mass392.18350
SMILES[H][C@@]12/C=C(/C)[C@@H](OC(C)=O)C[C@@]3([H])O[C@]3(C)C[C@@H](OC(=O)C(C)C)[C@@]1([H])C(=C)C(=O)O2
InChIInChI=1S/C21H28O7/c1-10(2)19(23)27-16-9-21(6)17(28-21)8-14(25-13(5)22)11(3)7-15-18(16)12(4)20(24)26-15/h7,10,14-18H,4,8-9H2,1-3,5-6H3/b11-7-/t14-,15+,16+,17+,18-,21+/m0/s1
InChIKeyVDPIGPWXCXCBKE-PTZLTHSXSA-N
ChEBI Ontology
Outgoing Relation(s)
Viguiestenin (CHEBI:9981) is a germacranolide (CHEBI:73011)
Synonym  Source
ViguiesteninKEGG COMPOUND
Manual XrefsDatabases
C09586KEGG COMPOUND
C00003391KNApSAcK
Registry NumbersSources
CAS:54153-71-8KEGG COMPOUND