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CHEBI:5363 - Gitogenin

Default Structure
ChEBI IDCHEBI:5363
ChEBI NameGitogenin
Stars
Last Modified28 July 2014
DownloadsMolfile
FormulaC27H44O4
Net Charge0
Average Mass432.645
Monoisotopic Mass432.32396
SMILES[H][C@@]12CC[C@]3([H])[C@]([H])(CC[C@@]4(C)[C@@]3([H])C[C@]3([H])O[C@]5(CC[C@@H](C)CO5)[C@@H](C)[C@]43[H])[C@@]1(C)C[C@@H](O)[C@H](O)C2
InChIInChI=1S/C27H44O4/c1-15-7-10-27(30-14-15)16(2)24-23(31-27)12-20-18-6-5-17-11-21(28)22(29)13-26(17,4)19(18)8-9-25(20,24)3/h15-24,28-29H,5-14H2,1-4H3/t15-,16+,17+,18-,19+,20+,21-,22-,23+,24+,25+,26+,27-/m1/s1
InChIKeyFWCXELAAYFYCSR-RYKNUXCGSA-N
ChEBI Ontology
Outgoing Relation(s)
Gitogenin (CHEBI:5363) is a triterpenoid (CHEBI:36615)
Synonym  Source
GitogeninKEGG COMPOUND
Manual XrefsDatabases
C00003577KNApSAcK
C08899KEGG COMPOUND
Registry NumbersSources
CAS:511-96-6KEGG COMPOUND