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CHEBI:2522 - Ailanthone

Default Structure
ChEBI IDCHEBI:2522
ChEBI NameAilanthone
Stars
Last Modified28 July 2014
DownloadsMolfile
FormulaC20H24O7
Net Charge0
Average Mass376.405
Monoisotopic Mass376.15220
SMILES[H][C@]12[C@@]3(C)[C@H](O)C(=O)C=C(C)[C@]3([H])C[C@@]3([H])OC(=O)C[C@@]4([H])C(=C)[C@@H](O)[C@]1(O)OC[C@]234
InChIInChI=1S/C20H24O7/c1-8-4-12(21)16(24)18(3)10(8)5-13-19-7-26-20(25,17(18)19)15(23)9(2)11(19)6-14(22)27-13/h4,10-11,13,15-17,23-25H,2,5-7H2,1,3H3/t10-,11-,13+,15+,16+,17+,18+,19+,20-/m0/s1
InChIKeyWBBVXGHSWZIJST-RLQYZCPESA-N
ChEBI Ontology
Outgoing Relation(s)
Ailanthone (CHEBI:2522) is a triterpenoid (CHEBI:36615)
Synonym  Source
AilanthoneKEGG COMPOUND
Manual XrefsDatabases
C00003697KNApSAcK
C08747KEGG COMPOUND
Registry NumbersSources
CAS:981-15-7KEGG COMPOUND