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CHEBI:8484 - Propapyriogenin A2

Default Structure
ChEBI IDCHEBI:8484
ChEBI NamePropapyriogenin A2
Stars
Last Modified28 July 2014
DownloadsMolfile
FormulaC30H44O5
Net Charge0
Average Mass484.677
Monoisotopic Mass484.31887
SMILES[H][C@]12[C@H](O)C=C3[C@]4([H])CC(C)(C)C(=O)C[C@]4(C(=O)O)CC[C@@]3(C)[C@]1(C)CC[C@@]1([H])C(C)(C)C(=O)CC[C@]21C
InChIInChI=1S/C30H44O5/c1-25(2)15-18-17-14-19(31)23-27(5)10-9-21(32)26(3,4)20(27)8-11-29(23,7)28(17,6)12-13-30(18,24(34)35)16-22(25)33/h14,18-20,23,31H,8-13,15-16H2,1-7H3,(H,34,35)/t18-,19+,20-,23+,27-,28+,29+,30+/m0/s1
InChIKeyLJMPUEBWSQXCRU-LJHQDYJOSA-N
ChEBI Ontology
Outgoing Relation(s)
Propapyriogenin A2 (CHEBI:8484) is a triterpenoid (CHEBI:36615)
Synonym  Source
Propapyriogenin A2KEGG COMPOUND
Manual XrefsDatabases
C00003545KNApSAcK
C08971KEGG COMPOUND
Registry NumbersSources
CAS:72933-74-5KEGG COMPOUND