CHEBI:5860 - Ichangin

ChEBI IDCHEBI:5860
ChEBI NameIchangin
Stars
Last Modified28 July 2014
DownloadsMolfile
FormulaC26H32O9
Net Charge0
Average Mass488.533
Monoisotopic Mass488.20463
SMILES[H][C@]12CC[C@@]3(C)[C@H](c4ccoc4)OC(=O)[C@H]4O[C@]43[C@]1(C)C(=O)C[C@@H](C(C)(C)O)[C@@]21COC(=O)C[C@@H]1O
InChIInChI=1S/C26H32O9/c1-22(2,31)15-9-16(27)24(4)14(25(15)12-33-18(29)10-17(25)28)5-7-23(3)19(13-6-8-32-11-13)34-21(30)20-26(23,24)35-20/h6,8,11,14-15,17,19-20,28,31H,5,7,9-10,12H2,1-4H3/t14-,15-,17-,19-,20+,23-,24-,25+,26+/m0/s1
InChIKeyGNNAZOFNKOMONV-MSGMIQHVSA-N
ChEBI Ontology
Outgoing Relation(s)
Ichangin (CHEBI:5860) is a sesquiterpenoid (CHEBI:26658)
Synonym  Source
IchanginKEGG COMPOUND
Manual XrefsDatabases
C08768KEGG COMPOUND
C00003716KNApSAcK
Registry NumbersSources
CAS:10171-61-6KEGG COMPOUND