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CHEBI:80889 - Picrasin A

Default Structure
ChEBI IDCHEBI:80889
ChEBI NamePicrasin A
Stars
DownloadsMolfile
FormulaC26H34O8
Net Charge0
Average Mass474.550
Monoisotopic Mass474.22537
SMILES[H][C@]12CC(=O)O[C@]3([H])C[C@@]4([H])[C@H](C)C=C(OC)C(=O)[C@]4(C)[C@@]([H])([C@H](O)C[C@@]1(C)C(=O)[C@H]1COC(=O)C1)[C@]23C
InChIInChI=1S/C26H34O8/c1-12-6-16(32-5)23(31)25(3)14(12)8-18-26(4)17(9-20(29)34-18)24(2,10-15(27)21(25)26)22(30)13-7-19(28)33-11-13/h6,12-15,17-18,21,27H,7-11H2,1-5H3/t12-,13-,14+,15-,17+,18-,21-,24-,25+,26-/m1/s1
InChIKeyBIJFTRIMTHYJOV-QRWZCSJESA-N
ChEBI Ontology
Outgoing Relation(s)
Picrasin A (CHEBI:80889) is a triterpenoid (CHEBI:36615)
Synonym  Source
Nigakilactone GKEGG COMPOUND
Manual XrefsDatabases
C17049KEGG COMPOUND
Registry NumbersSources
CAS:27368-79-2KEGG COMPOUND