CHEBI:10086 - Yamogenin

ChEBI IDCHEBI:10086
ChEBI NameYamogenin
Stars
Last Modified28 July 2014
DownloadsMolfile
FormulaC27H42O3
Net Charge0
Average Mass414.630
Monoisotopic Mass414.31340
SMILES[H][C@@]12CC=C3C[C@@H](O)CC[C@]3(C)[C@@]1([H])CC[C@@]1(C)[C@@]2([H])C[C@]2([H])O[C@]3(CC[C@H](C)CO3)[C@@H](C)[C@]12[H]
InChIInChI=1S/C27H42O3/c1-16-7-12-27(29-15-16)17(2)24-23(30-27)14-22-20-6-5-18-13-19(28)8-10-25(18,3)21(20)9-11-26(22,24)4/h5,16-17,19-24,28H,6-15H2,1-4H3/t16-,17-,19-,20+,21-,22-,23-,24-,25-,26-,27+/m0/s1
InChIKeyWQLVFSAGQJTQCK-CAKNJAFZSA-N
ChEBI Ontology
Outgoing Relation(s)
Yamogenin (CHEBI:10086) is a triterpenoid (CHEBI:36615)
Synonym  Source
YamogeninKEGG COMPOUND
Manual XrefsDatabases
C00003597KNApSAcK
C08918KEGG COMPOUND
Registry NumbersSources
CAS:512-06-1KEGG COMPOUND