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CHEBI:8913 - Ruscogenin

Default Structure
ChEBI IDCHEBI:8913
ChEBI NameRuscogenin
Stars
Last Modified28 July 2014
DownloadsMolfile
FormulaC27H42O4
Net Charge0
Average Mass430.629
Monoisotopic Mass430.30831
SMILES[H][C@@]12CC=C3C[C@@H](O)C[C@@H](O)[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/C27H42O4/c1-15-7-10-27(30-14-15)16(2)24-22(31-27)13-21-19-6-5-17-11-18(28)12-23(29)26(17,4)20(19)8-9-25(21,24)3/h5,15-16,18-24,28-29H,6-14H2,1-4H3/t15-,16+,18-,19-,20+,21+,22+,23-,24+,25+,26+,27-/m1/s1
InChIKeyQMQIQBOGXYYATH-IDABPMKMSA-N
ChEBI Ontology
Outgoing Relation(s)
Ruscogenin (CHEBI:8913) is a triterpenoid (CHEBI:36615)
Synonym  Source
RuscogeninKEGG COMPOUND
Manual XrefsDatabases
C00003587KNApSAcK
C08909KEGG COMPOUND
D08498KEGG DRUG
Registry NumbersSources
CAS:472-11-7KEGG COMPOUND